2025-01-03T07:20:55,163 Created temporary directory: /tmp/pip-build-tracker-agh7v33u 2025-01-03T07:20:55,164 Initialized build tracking at /tmp/pip-build-tracker-agh7v33u 2025-01-03T07:20:55,165 Created build tracker: /tmp/pip-build-tracker-agh7v33u 2025-01-03T07:20:55,165 Entered build tracker: /tmp/pip-build-tracker-agh7v33u 2025-01-03T07:20:55,166 Created temporary directory: /tmp/pip-wheel-bin6hqbn 2025-01-03T07:20:55,170 Created temporary directory: /tmp/pip-ephem-wheel-cache-xva92e_k 2025-01-03T07:20:55,214 Looking in indexes: https://pypi.org/simple, https://www.piwheels.org/simple 2025-01-03T07:20:55,216 2 location(s) to search for versions of benchmol: 2025-01-03T07:20:55,216 * https://pypi.org/simple/benchmol/ 2025-01-03T07:20:55,216 * https://www.piwheels.org/simple/benchmol/ 2025-01-03T07:20:55,217 Fetching project page and analyzing links: https://pypi.org/simple/benchmol/ 2025-01-03T07:20:55,218 Getting page https://pypi.org/simple/benchmol/ 2025-01-03T07:20:55,219 Found index url https://pypi.org/simple/ 2025-01-03T07:20:55,363 Fetched page https://pypi.org/simple/benchmol/ as application/vnd.pypi.simple.v1+json 2025-01-03T07:20:55,364 Found link https://files.pythonhosted.org/packages/b7/ba/45dfd1a30303dc5d0877404f3d7027d45aa70635fbf5c9cae5e583b5b296/benchmol-0.0.1.tar.gz (from https://pypi.org/simple/benchmol/) (requires-python:>=3.6), version: 0.0.1 2025-01-03T07:20:55,365 Found link https://files.pythonhosted.org/packages/a6/dc/2685ef0a4d0e510e77aa0adf82dc1a7b95c711bbb415b214dc9f4df1a0ec/benchmol-0.0.2.tar.gz (from https://pypi.org/simple/benchmol/) (requires-python:>=3.0), version: 0.0.2 2025-01-03T07:20:55,366 Fetching project page and analyzing links: https://www.piwheels.org/simple/benchmol/ 2025-01-03T07:20:55,367 Getting page https://www.piwheels.org/simple/benchmol/ 2025-01-03T07:20:55,368 Found index url https://www.piwheels.org/simple/ 2025-01-03T07:20:55,536 Fetched page https://www.piwheels.org/simple/benchmol/ as text/html 2025-01-03T07:20:55,537 Skipping link: not a file: https://www.piwheels.org/simple/benchmol/ 2025-01-03T07:20:55,538 Skipping link: not a file: https://pypi.org/simple/benchmol/ 2025-01-03T07:20:55,556 Given no hashes to check 1 links for project 'benchmol': discarding no candidates 2025-01-03T07:20:55,558 Collecting benchmol==0.0.2 2025-01-03T07:20:55,561 Created temporary directory: /tmp/pip-unpack-pcs6j4yn 2025-01-03T07:20:55,780 Downloading benchmol-0.0.2.tar.gz (352 kB) 2025-01-03T07:20:56,403 Added benchmol==0.0.2 from https://files.pythonhosted.org/packages/a6/dc/2685ef0a4d0e510e77aa0adf82dc1a7b95c711bbb415b214dc9f4df1a0ec/benchmol-0.0.2.tar.gz to build tracker '/tmp/pip-build-tracker-agh7v33u' 2025-01-03T07:20:56,405 Running setup.py (path:/tmp/pip-wheel-bin6hqbn/benchmol_4bbf095d5ee44bca883073a957af0af3/setup.py) egg_info for package benchmol 2025-01-03T07:20:56,406 Created temporary directory: /tmp/pip-pip-egg-info-dy8dzpcr 2025-01-03T07:20:56,406 Preparing metadata (setup.py): started 2025-01-03T07:20:56,408 Running command python setup.py egg_info 2025-01-03T07:20:57,482 running egg_info 2025-01-03T07:20:57,511 creating /tmp/pip-pip-egg-info-dy8dzpcr/benchmol.egg-info 2025-01-03T07:20:57,512 writing /tmp/pip-pip-egg-info-dy8dzpcr/benchmol.egg-info/PKG-INFO 2025-01-03T07:20:57,515 writing dependency_links to /tmp/pip-pip-egg-info-dy8dzpcr/benchmol.egg-info/dependency_links.txt 2025-01-03T07:20:57,518 writing top-level names to /tmp/pip-pip-egg-info-dy8dzpcr/benchmol.egg-info/top_level.txt 2025-01-03T07:20:57,520 writing manifest file '/tmp/pip-pip-egg-info-dy8dzpcr/benchmol.egg-info/SOURCES.txt' 2025-01-03T07:20:57,660 reading manifest file '/tmp/pip-pip-egg-info-dy8dzpcr/benchmol.egg-info/SOURCES.txt' 2025-01-03T07:20:57,672 writing manifest file '/tmp/pip-pip-egg-info-dy8dzpcr/benchmol.egg-info/SOURCES.txt' 2025-01-03T07:20:57,780 Preparing metadata (setup.py): finished with status 'done' 2025-01-03T07:20:57,785 Source in /tmp/pip-wheel-bin6hqbn/benchmol_4bbf095d5ee44bca883073a957af0af3 has version 0.0.2, which satisfies requirement benchmol==0.0.2 from https://files.pythonhosted.org/packages/a6/dc/2685ef0a4d0e510e77aa0adf82dc1a7b95c711bbb415b214dc9f4df1a0ec/benchmol-0.0.2.tar.gz 2025-01-03T07:20:57,786 Removed benchmol==0.0.2 from https://files.pythonhosted.org/packages/a6/dc/2685ef0a4d0e510e77aa0adf82dc1a7b95c711bbb415b214dc9f4df1a0ec/benchmol-0.0.2.tar.gz from build tracker '/tmp/pip-build-tracker-agh7v33u' 2025-01-03T07:20:57,793 Created temporary directory: /tmp/pip-unpack-5yy0ml2w 2025-01-03T07:20:57,794 Created temporary directory: /tmp/pip-unpack-s9_pvldx 2025-01-03T07:20:57,794 Building wheels for collected packages: benchmol 2025-01-03T07:20:57,800 Created temporary directory: /tmp/pip-wheel-em90j3bo 2025-01-03T07:20:57,801 Building wheel for benchmol (setup.py): started 2025-01-03T07:20:57,802 Destination directory: /tmp/pip-wheel-em90j3bo 2025-01-03T07:20:57,802 Running command python setup.py bdist_wheel 2025-01-03T07:20:58,832 running bdist_wheel 2025-01-03T07:20:58,965 running build 2025-01-03T07:20:58,966 running build_py 2025-01-03T07:20:58,995 creating build/lib/benchmol 2025-01-03T07:20:58,997 copying benchmol/__init__.py -> build/lib/benchmol 2025-01-03T07:20:59,000 creating build/lib/benchmol/configs 2025-01-03T07:20:59,001 copying benchmol/configs/model_params.py -> build/lib/benchmol/configs 2025-01-03T07:20:59,004 copying benchmol/configs/__init__.py -> build/lib/benchmol/configs 2025-01-03T07:20:59,005 copying benchmol/configs/StructureNet_params.py -> build/lib/benchmol/configs 2025-01-03T07:20:59,008 creating build/lib/benchmol/feature_extraction 2025-01-03T07:20:59,009 copying benchmol/feature_extraction/feature_extractor.py -> build/lib/benchmol/feature_extraction 2025-01-03T07:20:59,011 copying benchmol/feature_extraction/__init__.py -> build/lib/benchmol/feature_extraction 2025-01-03T07:20:59,014 creating build/lib/benchmol/trainer 2025-01-03T07:20:59,015 copying benchmol/trainer/__init__.py -> build/lib/benchmol/trainer 2025-01-03T07:20:59,017 copying benchmol/trainer/trainer.py -> build/lib/benchmol/trainer 2025-01-03T07:20:59,020 creating build/lib/benchmol/metrics 2025-01-03T07:20:59,021 copying benchmol/metrics/__init__.py -> build/lib/benchmol/metrics 2025-01-03T07:20:59,022 copying benchmol/metrics/metric.py -> build/lib/benchmol/metrics 2025-01-03T07:20:59,025 creating build/lib/benchmol/dataloader 2025-01-03T07:20:59,026 copying benchmol/dataloader/data_utils.py -> build/lib/benchmol/dataloader 2025-01-03T07:20:59,028 copying benchmol/dataloader/graph_dataset.py -> build/lib/benchmol/dataloader 2025-01-03T07:20:59,030 copying benchmol/dataloader/collater.py -> build/lib/benchmol/dataloader 2025-01-03T07:20:59,031 copying benchmol/dataloader/__init__.py -> build/lib/benchmol/dataloader 2025-01-03T07:20:59,033 copying benchmol/dataloader/image_dataset.py -> build/lib/benchmol/dataloader 2025-01-03T07:20:59,035 copying benchmol/dataloader/geometry_dataset.py -> build/lib/benchmol/dataloader 2025-01-03T07:20:59,038 copying benchmol/dataloader/sequence_dataset.py -> build/lib/benchmol/dataloader 2025-01-03T07:20:59,040 copying benchmol/dataloader/feat_dataset.py -> build/lib/benchmol/dataloader 2025-01-03T07:20:59,042 creating build/lib/benchmol/model_pools 2025-01-03T07:20:59,043 copying benchmol/model_pools/__init__.py -> build/lib/benchmol/model_pools 2025-01-03T07:20:59,045 copying benchmol/model_pools/image_factory.py -> build/lib/benchmol/model_pools 2025-01-03T07:20:59,048 copying benchmol/model_pools/geometry_factory.py -> build/lib/benchmol/model_pools 2025-01-03T07:20:59,051 copying benchmol/model_pools/smiles_factory.py -> build/lib/benchmol/model_pools 2025-01-03T07:20:59,053 copying benchmol/model_pools/base_utils.py -> build/lib/benchmol/model_pools 2025-01-03T07:20:59,055 copying benchmol/model_pools/graph_factory.py -> build/lib/benchmol/model_pools 2025-01-03T07:20:59,057 creating build/lib/benchmol/utils 2025-01-03T07:20:59,059 copying benchmol/utils/graph_utils.py -> build/lib/benchmol/utils 2025-01-03T07:20:59,062 copying benchmol/utils/__init__.py -> build/lib/benchmol/utils 2025-01-03T07:20:59,063 copying benchmol/utils/public_utils.py -> build/lib/benchmol/utils 2025-01-03T07:20:59,065 copying benchmol/utils/splitter.py -> build/lib/benchmol/utils 2025-01-03T07:20:59,067 copying benchmol/utils/logger.py -> build/lib/benchmol/utils 2025-01-03T07:20:59,069 copying benchmol/utils/evaluate.py -> build/lib/benchmol/utils 2025-01-03T07:20:59,072 creating build/lib/benchmol/data_process 2025-01-03T07:20:59,073 copying benchmol/data_process/__init__.py -> build/lib/benchmol/data_process 2025-01-03T07:20:59,075 creating build/lib/benchmol/model_pools/geom3d 2025-01-03T07:20:59,076 copying benchmol/model_pools/geom3d/molecule_gnn_model_simplified.py -> build/lib/benchmol/model_pools/geom3d 2025-01-03T07:20:59,079 copying benchmol/model_pools/geom3d/SphereNet_utils.py -> build/lib/benchmol/model_pools/geom3d 2025-01-03T07:20:59,081 copying benchmol/model_pools/geom3d/molecule_gnn_model.py -> build/lib/benchmol/model_pools/geom3d 2025-01-03T07:20:59,083 copying benchmol/model_pools/geom3d/AWARE.py -> build/lib/benchmol/model_pools/geom3d 2025-01-03T07:20:59,085 copying benchmol/model_pools/geom3d/DimeNetPlusPlus.py -> build/lib/benchmol/model_pools/geom3d 2025-01-03T07:20:59,087 copying benchmol/model_pools/geom3d/GeoSSL_DDM.py -> build/lib/benchmol/model_pools/geom3d 2025-01-03T07:20:59,089 copying benchmol/model_pools/geom3d/CNN.py -> build/lib/benchmol/model_pools/geom3d 2025-01-03T07:20:59,091 copying benchmol/model_pools/geom3d/TFN_utils.py -> build/lib/benchmol/model_pools/geom3d 2025-01-03T07:20:59,093 copying benchmol/model_pools/geom3d/SE3_Transformer.py -> build/lib/benchmol/model_pools/geom3d 2025-01-03T07:20:59,095 copying benchmol/model_pools/geom3d/BERT.py -> build/lib/benchmol/model_pools/geom3d 2025-01-03T07:20:59,097 copying benchmol/model_pools/geom3d/DimeNet.py -> build/lib/benchmol/model_pools/geom3d 2025-01-03T07:20:59,100 copying benchmol/model_pools/geom3d/SchNet.py -> build/lib/benchmol/model_pools/geom3d 2025-01-03T07:20:59,102 copying benchmol/model_pools/geom3d/AutoEncoder.py -> build/lib/benchmol/model_pools/geom3d 2025-01-03T07:20:59,104 copying benchmol/model_pools/geom3d/__init__.py -> build/lib/benchmol/model_pools/geom3d 2025-01-03T07:20:59,106 copying benchmol/model_pools/geom3d/GPS.py -> build/lib/benchmol/model_pools/geom3d 2025-01-03T07:20:59,108 copying benchmol/model_pools/geom3d/GearNet_layer.py -> build/lib/benchmol/model_pools/geom3d 2025-01-03T07:20:59,110 copying benchmol/model_pools/geom3d/DimeNet_utils.py -> build/lib/benchmol/model_pools/geom3d 2025-01-03T07:20:59,113 copying benchmol/model_pools/geom3d/GEM.py -> build/lib/benchmol/model_pools/geom3d 2025-01-03T07:20:59,115 copying benchmol/model_pools/geom3d/unimol.py -> build/lib/benchmol/model_pools/geom3d 2025-01-03T07:20:59,117 copying benchmol/model_pools/geom3d/EGNN.py -> build/lib/benchmol/model_pools/geom3d 2025-01-03T07:20:59,119 copying benchmol/model_pools/geom3d/SphereNet_periodic.py -> build/lib/benchmol/model_pools/geom3d 2025-01-03T07:20:59,121 copying benchmol/model_pools/geom3d/GVP.py -> build/lib/benchmol/model_pools/geom3d 2025-01-03T07:20:59,124 copying benchmol/model_pools/geom3d/GeoSSL_PDM.py -> build/lib/benchmol/model_pools/geom3d 2025-01-03T07:20:59,125 copying benchmol/model_pools/geom3d/PaiNN_utils.py -> build/lib/benchmol/model_pools/geom3d 2025-01-03T07:20:59,128 copying benchmol/model_pools/geom3d/MLP.py -> build/lib/benchmol/model_pools/geom3d 2025-01-03T07:20:59,130 copying benchmol/model_pools/geom3d/CDConv.py -> build/lib/benchmol/model_pools/geom3d 2025-01-03T07:20:59,132 copying benchmol/model_pools/geom3d/fibers.py -> build/lib/benchmol/model_pools/geom3d 2025-01-03T07:20:59,134 copying benchmol/model_pools/geom3d/SE3_Transformer_utils.py -> build/lib/benchmol/model_pools/geom3d 2025-01-03T07:20:59,137 copying benchmol/model_pools/geom3d/GearNet.py -> build/lib/benchmol/model_pools/geom3d 2025-01-03T07:20:59,139 copying benchmol/model_pools/geom3d/GPS_layer.py -> build/lib/benchmol/model_pools/geom3d 2025-01-03T07:20:59,141 copying benchmol/model_pools/geom3d/DMPNN.py -> build/lib/benchmol/model_pools/geom3d 2025-01-03T07:20:59,143 copying benchmol/model_pools/geom3d/ENN.py -> build/lib/benchmol/model_pools/geom3d 2025-01-03T07:20:59,145 copying benchmol/model_pools/geom3d/ClofNet.py -> build/lib/benchmol/model_pools/geom3d 2025-01-03T07:20:59,148 copying benchmol/model_pools/geom3d/SphereNet.py -> build/lib/benchmol/model_pools/geom3d 2025-01-03T07:20:59,150 copying benchmol/model_pools/geom3d/TFN.py -> build/lib/benchmol/model_pools/geom3d 2025-01-03T07:20:59,152 copying benchmol/model_pools/geom3d/PaiNN.py -> build/lib/benchmol/model_pools/geom3d 2025-01-03T07:20:59,155 copying benchmol/model_pools/geom3d/utils.py -> build/lib/benchmol/model_pools/geom3d 2025-01-03T07:20:59,157 creating build/lib/benchmol/model_pools/image 2025-01-03T07:20:59,158 copying benchmol/model_pools/image/__init__.py -> build/lib/benchmol/model_pools/image 2025-01-03T07:20:59,160 creating build/lib/benchmol/model_pools/graph 2025-01-03T07:20:59,161 copying benchmol/model_pools/graph/gnns_graphmvp_helper.py -> build/lib/benchmol/model_pools/graph 2025-01-03T07:20:59,163 copying benchmol/model_pools/graph/gnns_molebert.py -> build/lib/benchmol/model_pools/graph 2025-01-03T07:20:59,166 copying benchmol/model_pools/graph/deepergcn.py -> build/lib/benchmol/model_pools/graph 2025-01-03T07:20:59,168 copying benchmol/model_pools/graph/gnns.py -> build/lib/benchmol/model_pools/graph 2025-01-03T07:20:59,171 copying benchmol/model_pools/graph/__init__.py -> build/lib/benchmol/model_pools/graph 2025-01-03T07:20:59,172 copying benchmol/model_pools/graph/cgip.py -> build/lib/benchmol/model_pools/graph 2025-01-03T07:20:59,174 copying benchmol/model_pools/graph/cgip_helper.py -> build/lib/benchmol/model_pools/graph 2025-01-03T07:20:59,176 copying benchmol/model_pools/graph/gnns_graphmvp.py -> build/lib/benchmol/model_pools/graph 2025-01-03T07:20:59,179 creating build/lib/benchmol/model_pools/smiles 2025-01-03T07:20:59,180 copying benchmol/model_pools/smiles/chembert.py -> build/lib/benchmol/model_pools/smiles 2025-01-03T07:20:59,182 copying benchmol/model_pools/smiles/__init__.py -> build/lib/benchmol/model_pools/smiles 2025-01-03T07:20:59,184 copying benchmol/model_pools/smiles/molformer.py -> build/lib/benchmol/model_pools/smiles 2025-01-03T07:20:59,186 copying benchmol/model_pools/smiles/abc_smiles.py -> build/lib/benchmol/model_pools/smiles 2025-01-03T07:20:59,189 creating build/lib/benchmol/model_pools/geom3d/Equiformer 2025-01-03T07:20:59,190 copying benchmol/model_pools/geom3d/Equiformer/radial_func.py -> build/lib/benchmol/model_pools/geom3d/Equiformer 2025-01-03T07:20:59,192 copying benchmol/model_pools/geom3d/Equiformer/equiformer_type_01.py -> build/lib/benchmol/model_pools/geom3d/Equiformer 2025-01-03T07:20:59,195 copying benchmol/model_pools/geom3d/Equiformer/layer_norm.py -> build/lib/benchmol/model_pools/geom3d/Equiformer 2025-01-03T07:20:59,197 copying benchmol/model_pools/geom3d/Equiformer/instance_norm.py -> build/lib/benchmol/model_pools/geom3d/Equiformer 2025-01-03T07:20:59,200 copying benchmol/model_pools/geom3d/Equiformer/drop.py -> build/lib/benchmol/model_pools/geom3d/Equiformer 2025-01-03T07:20:59,202 copying benchmol/model_pools/geom3d/Equiformer/equiformer_type_0.py -> build/lib/benchmol/model_pools/geom3d/Equiformer 2025-01-03T07:20:59,205 copying benchmol/model_pools/geom3d/Equiformer/radial_basis.py -> build/lib/benchmol/model_pools/geom3d/Equiformer 2025-01-03T07:20:59,207 copying benchmol/model_pools/geom3d/Equiformer/fast_layer_norm.py -> build/lib/benchmol/model_pools/geom3d/Equiformer 2025-01-03T07:20:59,209 copying benchmol/model_pools/geom3d/Equiformer/__init__.py -> build/lib/benchmol/model_pools/geom3d/Equiformer 2025-01-03T07:20:59,211 copying benchmol/model_pools/geom3d/Equiformer/expnorm_rbf.py -> build/lib/benchmol/model_pools/geom3d/Equiformer 2025-01-03T07:20:59,213 copying benchmol/model_pools/geom3d/Equiformer/equiformer_type_0_periodic.py -> build/lib/benchmol/model_pools/geom3d/Equiformer 2025-01-03T07:20:59,216 copying benchmol/model_pools/geom3d/Equiformer/tensor_product_rescale.py -> build/lib/benchmol/model_pools/geom3d/Equiformer 2025-01-03T07:20:59,218 copying benchmol/model_pools/geom3d/Equiformer/fast_activation.py -> build/lib/benchmol/model_pools/geom3d/Equiformer 2025-01-03T07:20:59,221 copying benchmol/model_pools/geom3d/Equiformer/graph_norm.py -> build/lib/benchmol/model_pools/geom3d/Equiformer 2025-01-03T07:20:59,223 copying benchmol/model_pools/geom3d/Equiformer/gaussian_rbf.py -> build/lib/benchmol/model_pools/geom3d/Equiformer 2025-01-03T07:20:59,225 creating build/lib/benchmol/model_pools/geom3d/Allegro 2025-01-03T07:20:59,226 copying benchmol/model_pools/geom3d/Allegro/_keys.py -> build/lib/benchmol/model_pools/geom3d/Allegro 2025-01-03T07:20:59,228 copying benchmol/model_pools/geom3d/Allegro/__init__.py -> build/lib/benchmol/model_pools/geom3d/Allegro 2025-01-03T07:20:59,230 creating build/lib/benchmol/model_pools/geom3d/from_se3cnn 2025-01-03T07:20:59,232 copying benchmol/model_pools/geom3d/from_se3cnn/SO3.py -> build/lib/benchmol/model_pools/geom3d/from_se3cnn 2025-01-03T07:20:59,234 copying benchmol/model_pools/geom3d/from_se3cnn/representations.py -> build/lib/benchmol/model_pools/geom3d/from_se3cnn 2025-01-03T07:20:59,237 copying benchmol/model_pools/geom3d/from_se3cnn/__init__.py -> build/lib/benchmol/model_pools/geom3d/from_se3cnn 2025-01-03T07:20:59,238 copying benchmol/model_pools/geom3d/from_se3cnn/utils_steerable.py -> build/lib/benchmol/model_pools/geom3d/from_se3cnn 2025-01-03T07:20:59,241 copying benchmol/model_pools/geom3d/from_se3cnn/cache_file.py -> build/lib/benchmol/model_pools/geom3d/from_se3cnn 2025-01-03T07:20:59,243 creating build/lib/benchmol/model_pools/geom3d/SEGNN 2025-01-03T07:20:59,244 copying benchmol/model_pools/geom3d/SEGNN/SEGNN.py -> build/lib/benchmol/model_pools/geom3d/SEGNN 2025-01-03T07:20:59,246 copying benchmol/model_pools/geom3d/SEGNN/node_attribute_network.py -> build/lib/benchmol/model_pools/geom3d/SEGNN 2025-01-03T07:20:59,248 copying benchmol/model_pools/geom3d/SEGNN/instance_norm.py -> build/lib/benchmol/model_pools/geom3d/SEGNN 2025-01-03T07:20:59,250 copying benchmol/model_pools/geom3d/SEGNN/__init__.py -> build/lib/benchmol/model_pools/geom3d/SEGNN 2025-01-03T07:20:59,252 copying benchmol/model_pools/geom3d/SEGNN/balanced_irreps.py -> build/lib/benchmol/model_pools/geom3d/SEGNN 2025-01-03T07:20:59,254 copying benchmol/model_pools/geom3d/SEGNN/o3_building_blocks.py -> build/lib/benchmol/model_pools/geom3d/SEGNN 2025-01-03T07:20:59,257 creating build/lib/benchmol/model_pools/geom3d/GemNet 2025-01-03T07:20:59,258 copying benchmol/model_pools/geom3d/GemNet/initializers.py -> build/lib/benchmol/model_pools/geom3d/GemNet 2025-01-03T07:20:59,260 copying benchmol/model_pools/geom3d/GemNet/__init__.py -> build/lib/benchmol/model_pools/geom3d/GemNet 2025-01-03T07:20:59,262 copying benchmol/model_pools/geom3d/GemNet/utils.py -> build/lib/benchmol/model_pools/geom3d/GemNet 2025-01-03T07:20:59,263 copying benchmol/model_pools/geom3d/GemNet/GemNet.py -> build/lib/benchmol/model_pools/geom3d/GemNet 2025-01-03T07:20:59,267 creating build/lib/benchmol/model_pools/geom3d/ProNet 2025-01-03T07:20:59,268 copying benchmol/model_pools/geom3d/ProNet/ProNet.py -> build/lib/benchmol/model_pools/geom3d/ProNet 2025-01-03T07:20:59,271 copying benchmol/model_pools/geom3d/ProNet/__init__.py -> build/lib/benchmol/model_pools/geom3d/ProNet 2025-01-03T07:20:59,273 copying benchmol/model_pools/geom3d/ProNet/features.py -> build/lib/benchmol/model_pools/geom3d/ProNet 2025-01-03T07:20:59,275 creating build/lib/benchmol/model_pools/geom3d/TransformerM 2025-01-03T07:20:59,277 copying benchmol/model_pools/geom3d/TransformerM/transformer_m.py -> build/lib/benchmol/model_pools/geom3d/TransformerM 2025-01-03T07:20:59,279 copying benchmol/model_pools/geom3d/TransformerM/transformer_m_encoder.py -> build/lib/benchmol/model_pools/geom3d/TransformerM 2025-01-03T07:20:59,281 copying benchmol/model_pools/geom3d/TransformerM/__init__.py -> build/lib/benchmol/model_pools/geom3d/TransformerM 2025-01-03T07:20:59,284 creating build/lib/benchmol/model_pools/geom3d/Graphormer 2025-01-03T07:20:59,285 copying benchmol/model_pools/geom3d/Graphormer/graphormer_graph_encoder.py -> build/lib/benchmol/model_pools/geom3d/Graphormer 2025-01-03T07:20:59,287 copying benchmol/model_pools/geom3d/Graphormer/__init__.py -> build/lib/benchmol/model_pools/geom3d/Graphormer 2025-01-03T07:20:59,289 copying benchmol/model_pools/geom3d/Graphormer/graphormer.py -> build/lib/benchmol/model_pools/geom3d/Graphormer 2025-01-03T07:20:59,291 creating build/lib/benchmol/model_pools/geom3d/UniMol 2025-01-03T07:20:59,292 copying benchmol/model_pools/geom3d/UniMol/__init__.py -> build/lib/benchmol/model_pools/geom3d/UniMol 2025-01-03T07:20:59,294 creating build/lib/benchmol/model_pools/geom3d/PNA 2025-01-03T07:20:59,295 copying benchmol/model_pools/geom3d/PNA/__init__.py -> build/lib/benchmol/model_pools/geom3d/PNA 2025-01-03T07:20:59,297 copying benchmol/model_pools/geom3d/PNA/aggregators.py -> build/lib/benchmol/model_pools/geom3d/PNA 2025-01-03T07:20:59,299 copying benchmol/model_pools/geom3d/PNA/PNA.py -> build/lib/benchmol/model_pools/geom3d/PNA 2025-01-03T07:20:59,301 copying benchmol/model_pools/geom3d/PNA/scalers.py -> build/lib/benchmol/model_pools/geom3d/PNA 2025-01-03T07:20:59,303 creating build/lib/benchmol/model_pools/geom3d/NequIP 2025-01-03T07:20:59,304 copying benchmol/model_pools/geom3d/NequIP/__init__.py -> build/lib/benchmol/model_pools/geom3d/NequIP 2025-01-03T07:20:59,307 creating build/lib/benchmol/model_pools/geom3d/Allegro/nn 2025-01-03T07:20:59,308 copying benchmol/model_pools/geom3d/Allegro/nn/_fc.py -> build/lib/benchmol/model_pools/geom3d/Allegro/nn 2025-01-03T07:20:59,310 copying benchmol/model_pools/geom3d/Allegro/nn/cutoffs.py -> build/lib/benchmol/model_pools/geom3d/Allegro/nn 2025-01-03T07:20:59,312 copying benchmol/model_pools/geom3d/Allegro/nn/__init__.py -> build/lib/benchmol/model_pools/geom3d/Allegro/nn 2025-01-03T07:20:59,314 copying benchmol/model_pools/geom3d/Allegro/nn/_norm_basis.py -> build/lib/benchmol/model_pools/geom3d/Allegro/nn 2025-01-03T07:20:59,316 copying benchmol/model_pools/geom3d/Allegro/nn/_allegro.py -> build/lib/benchmol/model_pools/geom3d/Allegro/nn 2025-01-03T07:20:59,319 copying benchmol/model_pools/geom3d/Allegro/nn/_edgewise.py -> build/lib/benchmol/model_pools/geom3d/Allegro/nn 2025-01-03T07:20:59,321 creating build/lib/benchmol/model_pools/geom3d/Allegro/model 2025-01-03T07:20:59,322 copying benchmol/model_pools/geom3d/Allegro/model/__init__.py -> build/lib/benchmol/model_pools/geom3d/Allegro/model 2025-01-03T07:20:59,324 copying benchmol/model_pools/geom3d/Allegro/model/Allegro.py -> build/lib/benchmol/model_pools/geom3d/Allegro/model 2025-01-03T07:20:59,327 creating build/lib/benchmol/model_pools/geom3d/Allegro/nn/_strided 2025-01-03T07:20:59,328 copying benchmol/model_pools/geom3d/Allegro/nn/_strided/_spmm.py -> build/lib/benchmol/model_pools/geom3d/Allegro/nn/_strided 2025-01-03T07:20:59,330 copying benchmol/model_pools/geom3d/Allegro/nn/_strided/_linear.py -> build/lib/benchmol/model_pools/geom3d/Allegro/nn/_strided 2025-01-03T07:20:59,332 copying benchmol/model_pools/geom3d/Allegro/nn/_strided/_layout.py -> build/lib/benchmol/model_pools/geom3d/Allegro/nn/_strided 2025-01-03T07:20:59,334 copying benchmol/model_pools/geom3d/Allegro/nn/_strided/__init__.py -> build/lib/benchmol/model_pools/geom3d/Allegro/nn/_strided 2025-01-03T07:20:59,336 copying benchmol/model_pools/geom3d/Allegro/nn/_strided/_channels.py -> build/lib/benchmol/model_pools/geom3d/Allegro/nn/_strided 2025-01-03T07:20:59,338 copying benchmol/model_pools/geom3d/Allegro/nn/_strided/_contract.py -> build/lib/benchmol/model_pools/geom3d/Allegro/nn/_strided 2025-01-03T07:20:59,341 creating build/lib/benchmol/model_pools/geom3d/TransformerM/modules 2025-01-03T07:20:59,342 copying benchmol/model_pools/geom3d/TransformerM/modules/layer_norm.py -> build/lib/benchmol/model_pools/geom3d/TransformerM/modules 2025-01-03T07:20:59,344 copying benchmol/model_pools/geom3d/TransformerM/modules/__init__.py -> build/lib/benchmol/model_pools/geom3d/TransformerM/modules 2025-01-03T07:20:59,346 copying benchmol/model_pools/geom3d/TransformerM/modules/droppath.py -> build/lib/benchmol/model_pools/geom3d/TransformerM/modules 2025-01-03T07:20:59,348 copying benchmol/model_pools/geom3d/TransformerM/modules/quant_noise.py -> build/lib/benchmol/model_pools/geom3d/TransformerM/modules 2025-01-03T07:20:59,350 copying benchmol/model_pools/geom3d/TransformerM/modules/fairseq_dropout.py -> build/lib/benchmol/model_pools/geom3d/TransformerM/modules 2025-01-03T07:20:59,352 copying benchmol/model_pools/geom3d/TransformerM/modules/layer_drop.py -> build/lib/benchmol/model_pools/geom3d/TransformerM/modules 2025-01-03T07:20:59,354 copying benchmol/model_pools/geom3d/TransformerM/modules/utils.py -> build/lib/benchmol/model_pools/geom3d/TransformerM/modules 2025-01-03T07:20:59,356 creating build/lib/benchmol/model_pools/geom3d/TransformerM/layers 2025-01-03T07:20:59,357 copying benchmol/model_pools/geom3d/TransformerM/layers/__init__.py -> build/lib/benchmol/model_pools/geom3d/TransformerM/layers 2025-01-03T07:20:59,359 copying benchmol/model_pools/geom3d/TransformerM/layers/transformer_m_encoder_layer.py -> build/lib/benchmol/model_pools/geom3d/TransformerM/layers 2025-01-03T07:20:59,361 copying benchmol/model_pools/geom3d/TransformerM/layers/multihead_attention.py -> build/lib/benchmol/model_pools/geom3d/TransformerM/layers 2025-01-03T07:20:59,363 copying benchmol/model_pools/geom3d/TransformerM/layers/transformer_m_layers.py -> build/lib/benchmol/model_pools/geom3d/TransformerM/layers 2025-01-03T07:20:59,366 creating build/lib/benchmol/model_pools/geom3d/Graphormer/modules 2025-01-03T07:20:59,368 copying benchmol/model_pools/geom3d/Graphormer/modules/layer_norm.py -> build/lib/benchmol/model_pools/geom3d/Graphormer/modules 2025-01-03T07:20:59,370 copying benchmol/model_pools/geom3d/Graphormer/modules/__init__.py -> build/lib/benchmol/model_pools/geom3d/Graphormer/modules 2025-01-03T07:20:59,371 copying benchmol/model_pools/geom3d/Graphormer/modules/quant_noise.py -> build/lib/benchmol/model_pools/geom3d/Graphormer/modules 2025-01-03T07:20:59,374 copying benchmol/model_pools/geom3d/Graphormer/modules/fairseq_dropout.py -> build/lib/benchmol/model_pools/geom3d/Graphormer/modules 2025-01-03T07:20:59,376 copying benchmol/model_pools/geom3d/Graphormer/modules/layer_drop.py -> build/lib/benchmol/model_pools/geom3d/Graphormer/modules 2025-01-03T07:20:59,378 copying benchmol/model_pools/geom3d/Graphormer/modules/utils.py -> build/lib/benchmol/model_pools/geom3d/Graphormer/modules 2025-01-03T07:20:59,380 creating build/lib/benchmol/model_pools/geom3d/Graphormer/layers 2025-01-03T07:20:59,381 copying benchmol/model_pools/geom3d/Graphormer/layers/__init__.py -> build/lib/benchmol/model_pools/geom3d/Graphormer/layers 2025-01-03T07:20:59,383 copying benchmol/model_pools/geom3d/Graphormer/layers/graphormer_graph_encoder_layer.py -> build/lib/benchmol/model_pools/geom3d/Graphormer/layers 2025-01-03T07:20:59,386 copying benchmol/model_pools/geom3d/Graphormer/layers/graphormer_layers.py -> build/lib/benchmol/model_pools/geom3d/Graphormer/layers 2025-01-03T07:20:59,388 copying benchmol/model_pools/geom3d/Graphormer/layers/multihead_attention.py -> build/lib/benchmol/model_pools/geom3d/Graphormer/layers 2025-01-03T07:20:59,391 creating build/lib/benchmol/model_pools/geom3d/UniMol/unimol_tools 2025-01-03T07:20:59,393 copying benchmol/model_pools/geom3d/UniMol/unimol_tools/predictor.py -> build/lib/benchmol/model_pools/geom3d/UniMol/unimol_tools 2025-01-03T07:20:59,395 copying benchmol/model_pools/geom3d/UniMol/unimol_tools/__init__.py -> build/lib/benchmol/model_pools/geom3d/UniMol/unimol_tools 2025-01-03T07:20:59,397 copying benchmol/model_pools/geom3d/UniMol/unimol_tools/predict.py -> build/lib/benchmol/model_pools/geom3d/UniMol/unimol_tools 2025-01-03T07:20:59,399 copying benchmol/model_pools/geom3d/UniMol/unimol_tools/train.py -> build/lib/benchmol/model_pools/geom3d/UniMol/unimol_tools 2025-01-03T07:20:59,403 creating build/lib/benchmol/model_pools/geom3d/UniMol/unimol_tools/models 2025-01-03T07:20:59,404 copying benchmol/model_pools/geom3d/UniMol/unimol_tools/models/nnmodel.py -> build/lib/benchmol/model_pools/geom3d/UniMol/unimol_tools/models 2025-01-03T07:20:59,406 copying benchmol/model_pools/geom3d/UniMol/unimol_tools/models/loss.py -> build/lib/benchmol/model_pools/geom3d/UniMol/unimol_tools/models 2025-01-03T07:20:59,409 copying benchmol/model_pools/geom3d/UniMol/unimol_tools/models/__init__.py -> build/lib/benchmol/model_pools/geom3d/UniMol/unimol_tools/models 2025-01-03T07:20:59,410 copying benchmol/model_pools/geom3d/UniMol/unimol_tools/models/unimol.py -> build/lib/benchmol/model_pools/geom3d/UniMol/unimol_tools/models 2025-01-03T07:20:59,413 copying benchmol/model_pools/geom3d/UniMol/unimol_tools/models/transformers.py -> build/lib/benchmol/model_pools/geom3d/UniMol/unimol_tools/models 2025-01-03T07:20:59,416 creating build/lib/benchmol/model_pools/geom3d/UniMol/unimol_tools/tasks 2025-01-03T07:20:59,417 copying benchmol/model_pools/geom3d/UniMol/unimol_tools/tasks/split.py -> build/lib/benchmol/model_pools/geom3d/UniMol/unimol_tools/tasks 2025-01-03T07:20:59,419 copying benchmol/model_pools/geom3d/UniMol/unimol_tools/tasks/__init__.py -> build/lib/benchmol/model_pools/geom3d/UniMol/unimol_tools/tasks 2025-01-03T07:20:59,421 copying benchmol/model_pools/geom3d/UniMol/unimol_tools/tasks/trainer.py -> build/lib/benchmol/model_pools/geom3d/UniMol/unimol_tools/tasks 2025-01-03T07:20:59,425 creating build/lib/benchmol/model_pools/geom3d/UniMol/unimol_tools/config 2025-01-03T07:20:59,426 copying benchmol/model_pools/geom3d/UniMol/unimol_tools/config/__init__.py -> build/lib/benchmol/model_pools/geom3d/UniMol/unimol_tools/config 2025-01-03T07:20:59,428 copying benchmol/model_pools/geom3d/UniMol/unimol_tools/config/model_config.py -> build/lib/benchmol/model_pools/geom3d/UniMol/unimol_tools/config 2025-01-03T07:20:59,431 creating build/lib/benchmol/model_pools/geom3d/UniMol/unimol_tools/weights 2025-01-03T07:20:59,432 copying benchmol/model_pools/geom3d/UniMol/unimol_tools/weights/__init__.py -> build/lib/benchmol/model_pools/geom3d/UniMol/unimol_tools/weights 2025-01-03T07:20:59,434 copying benchmol/model_pools/geom3d/UniMol/unimol_tools/weights/weighthub.py -> build/lib/benchmol/model_pools/geom3d/UniMol/unimol_tools/weights 2025-01-03T07:20:59,437 creating build/lib/benchmol/model_pools/geom3d/UniMol/unimol_tools/utils 2025-01-03T07:20:59,438 copying benchmol/model_pools/geom3d/UniMol/unimol_tools/utils/config_handler.py -> build/lib/benchmol/model_pools/geom3d/UniMol/unimol_tools/utils 2025-01-03T07:20:59,440 copying benchmol/model_pools/geom3d/UniMol/unimol_tools/utils/util.py -> build/lib/benchmol/model_pools/geom3d/UniMol/unimol_tools/utils 2025-01-03T07:20:59,442 copying benchmol/model_pools/geom3d/UniMol/unimol_tools/utils/__init__.py -> build/lib/benchmol/model_pools/geom3d/UniMol/unimol_tools/utils 2025-01-03T07:20:59,444 copying benchmol/model_pools/geom3d/UniMol/unimol_tools/utils/metrics.py -> build/lib/benchmol/model_pools/geom3d/UniMol/unimol_tools/utils 2025-01-03T07:20:59,446 copying benchmol/model_pools/geom3d/UniMol/unimol_tools/utils/base_logger.py -> build/lib/benchmol/model_pools/geom3d/UniMol/unimol_tools/utils 2025-01-03T07:20:59,449 creating build/lib/benchmol/model_pools/geom3d/UniMol/unimol_tools/data 2025-01-03T07:20:59,450 copying benchmol/model_pools/geom3d/UniMol/unimol_tools/data/datascaler.py -> build/lib/benchmol/model_pools/geom3d/UniMol/unimol_tools/data 2025-01-03T07:20:59,453 copying benchmol/model_pools/geom3d/UniMol/unimol_tools/data/__init__.py -> build/lib/benchmol/model_pools/geom3d/UniMol/unimol_tools/data 2025-01-03T07:20:59,455 copying benchmol/model_pools/geom3d/UniMol/unimol_tools/data/dictionary.py -> build/lib/benchmol/model_pools/geom3d/UniMol/unimol_tools/data 2025-01-03T07:20:59,457 copying benchmol/model_pools/geom3d/UniMol/unimol_tools/data/datahub.py -> build/lib/benchmol/model_pools/geom3d/UniMol/unimol_tools/data 2025-01-03T07:20:59,459 copying benchmol/model_pools/geom3d/UniMol/unimol_tools/data/datareader.py -> build/lib/benchmol/model_pools/geom3d/UniMol/unimol_tools/data 2025-01-03T07:20:59,462 copying benchmol/model_pools/geom3d/UniMol/unimol_tools/data/conformer.py -> build/lib/benchmol/model_pools/geom3d/UniMol/unimol_tools/data 2025-01-03T07:20:59,465 creating build/lib/benchmol/model_pools/geom3d/NequIP/nn 2025-01-03T07:20:59,466 copying benchmol/model_pools/geom3d/NequIP/nn/_interaction_block.py -> build/lib/benchmol/model_pools/geom3d/NequIP/nn 2025-01-03T07:20:59,468 copying benchmol/model_pools/geom3d/NequIP/nn/_grad_output.py -> build/lib/benchmol/model_pools/geom3d/NequIP/nn 2025-01-03T07:20:59,470 copying benchmol/model_pools/geom3d/NequIP/nn/cutoffs.py -> build/lib/benchmol/model_pools/geom3d/NequIP/nn 2025-01-03T07:20:59,472 copying benchmol/model_pools/geom3d/NequIP/nn/_rescale.py -> build/lib/benchmol/model_pools/geom3d/NequIP/nn 2025-01-03T07:20:59,474 copying benchmol/model_pools/geom3d/NequIP/nn/radial_basis.py -> build/lib/benchmol/model_pools/geom3d/NequIP/nn 2025-01-03T07:20:59,477 copying benchmol/model_pools/geom3d/NequIP/nn/__init__.py -> build/lib/benchmol/model_pools/geom3d/NequIP/nn 2025-01-03T07:20:59,478 copying benchmol/model_pools/geom3d/NequIP/nn/_convnetlayer.py -> build/lib/benchmol/model_pools/geom3d/NequIP/nn 2025-01-03T07:20:59,481 copying benchmol/model_pools/geom3d/NequIP/nn/_concat.py -> build/lib/benchmol/model_pools/geom3d/NequIP/nn 2025-01-03T07:20:59,482 copying benchmol/model_pools/geom3d/NequIP/nn/_graph_mixin.py -> build/lib/benchmol/model_pools/geom3d/NequIP/nn 2025-01-03T07:20:59,485 copying benchmol/model_pools/geom3d/NequIP/nn/_util.py -> build/lib/benchmol/model_pools/geom3d/NequIP/nn 2025-01-03T07:20:59,487 copying benchmol/model_pools/geom3d/NequIP/nn/nonlinearities.py -> build/lib/benchmol/model_pools/geom3d/NequIP/nn 2025-01-03T07:20:59,488 copying benchmol/model_pools/geom3d/NequIP/nn/_atomwise.py -> build/lib/benchmol/model_pools/geom3d/NequIP/nn 2025-01-03T07:20:59,491 creating build/lib/benchmol/model_pools/geom3d/NequIP/scripts 2025-01-03T07:20:59,493 copying benchmol/model_pools/geom3d/NequIP/scripts/run_md.py -> build/lib/benchmol/model_pools/geom3d/NequIP/scripts 2025-01-03T07:20:59,495 copying benchmol/model_pools/geom3d/NequIP/scripts/__init__.py -> build/lib/benchmol/model_pools/geom3d/NequIP/scripts 2025-01-03T07:20:59,496 copying benchmol/model_pools/geom3d/NequIP/scripts/deploy.py -> build/lib/benchmol/model_pools/geom3d/NequIP/scripts 2025-01-03T07:20:59,499 copying benchmol/model_pools/geom3d/NequIP/scripts/train.py -> build/lib/benchmol/model_pools/geom3d/NequIP/scripts 2025-01-03T07:20:59,501 copying benchmol/model_pools/geom3d/NequIP/scripts/benchmark.py -> build/lib/benchmol/model_pools/geom3d/NequIP/scripts 2025-01-03T07:20:59,504 copying benchmol/model_pools/geom3d/NequIP/scripts/_logger.py -> build/lib/benchmol/model_pools/geom3d/NequIP/scripts 2025-01-03T07:20:59,506 copying benchmol/model_pools/geom3d/NequIP/scripts/evaluate.py -> build/lib/benchmol/model_pools/geom3d/NequIP/scripts 2025-01-03T07:20:59,509 creating build/lib/benchmol/model_pools/geom3d/NequIP/utils 2025-01-03T07:20:59,510 copying benchmol/model_pools/geom3d/NequIP/utils/wandb.py -> build/lib/benchmol/model_pools/geom3d/NequIP/utils 2025-01-03T07:20:59,512 copying benchmol/model_pools/geom3d/NequIP/utils/modules.py -> build/lib/benchmol/model_pools/geom3d/NequIP/utils 2025-01-03T07:20:59,514 copying benchmol/model_pools/geom3d/NequIP/utils/scatter.py -> build/lib/benchmol/model_pools/geom3d/NequIP/utils 2025-01-03T07:20:59,515 copying benchmol/model_pools/geom3d/NequIP/utils/test.py -> build/lib/benchmol/model_pools/geom3d/NequIP/utils 2025-01-03T07:20:59,518 copying benchmol/model_pools/geom3d/NequIP/utils/auto_init.py -> build/lib/benchmol/model_pools/geom3d/NequIP/utils 2025-01-03T07:20:59,521 copying benchmol/model_pools/geom3d/NequIP/utils/tp_utils.py -> build/lib/benchmol/model_pools/geom3d/NequIP/utils 2025-01-03T07:20:59,522 copying benchmol/model_pools/geom3d/NequIP/utils/config.py -> build/lib/benchmol/model_pools/geom3d/NequIP/utils 2025-01-03T07:20:59,525 copying benchmol/model_pools/geom3d/NequIP/utils/versions.py -> build/lib/benchmol/model_pools/geom3d/NequIP/utils 2025-01-03T07:20:59,526 copying benchmol/model_pools/geom3d/NequIP/utils/__init__.py -> build/lib/benchmol/model_pools/geom3d/NequIP/utils 2025-01-03T07:20:59,528 copying benchmol/model_pools/geom3d/NequIP/utils/git.py -> build/lib/benchmol/model_pools/geom3d/NequIP/utils 2025-01-03T07:20:59,530 copying benchmol/model_pools/geom3d/NequIP/utils/_global_options.py -> build/lib/benchmol/model_pools/geom3d/NequIP/utils 2025-01-03T07:20:59,532 copying benchmol/model_pools/geom3d/NequIP/utils/output.py -> build/lib/benchmol/model_pools/geom3d/NequIP/utils 2025-01-03T07:20:59,534 copying benchmol/model_pools/geom3d/NequIP/utils/multiprocessing.py -> build/lib/benchmol/model_pools/geom3d/NequIP/utils 2025-01-03T07:20:59,535 copying benchmol/model_pools/geom3d/NequIP/utils/regressor.py -> build/lib/benchmol/model_pools/geom3d/NequIP/utils 2025-01-03T07:20:59,538 copying benchmol/model_pools/geom3d/NequIP/utils/savenload.py -> build/lib/benchmol/model_pools/geom3d/NequIP/utils 2025-01-03T07:20:59,540 copying benchmol/model_pools/geom3d/NequIP/utils/misc.py -> build/lib/benchmol/model_pools/geom3d/NequIP/utils 2025-01-03T07:20:59,542 copying benchmol/model_pools/geom3d/NequIP/utils/batch_ops.py -> build/lib/benchmol/model_pools/geom3d/NequIP/utils 2025-01-03T07:20:59,544 creating build/lib/benchmol/model_pools/geom3d/NequIP/model 2025-01-03T07:20:59,545 copying benchmol/model_pools/geom3d/NequIP/model/_weight_init.py -> build/lib/benchmol/model_pools/geom3d/NequIP/model 2025-01-03T07:20:59,547 copying benchmol/model_pools/geom3d/NequIP/model/_scaling.py -> build/lib/benchmol/model_pools/geom3d/NequIP/model 2025-01-03T07:20:59,550 copying benchmol/model_pools/geom3d/NequIP/model/__init__.py -> build/lib/benchmol/model_pools/geom3d/NequIP/model 2025-01-03T07:20:59,551 copying benchmol/model_pools/geom3d/NequIP/model/_build.py -> build/lib/benchmol/model_pools/geom3d/NequIP/model 2025-01-03T07:20:59,553 copying benchmol/model_pools/geom3d/NequIP/model/_eng.py -> build/lib/benchmol/model_pools/geom3d/NequIP/model 2025-01-03T07:20:59,556 copying benchmol/model_pools/geom3d/NequIP/model/_grads.py -> build/lib/benchmol/model_pools/geom3d/NequIP/model 2025-01-03T07:20:59,558 copying benchmol/model_pools/geom3d/NequIP/model/builder_utils.py -> build/lib/benchmol/model_pools/geom3d/NequIP/model 2025-01-03T07:20:59,561 creating build/lib/benchmol/model_pools/geom3d/NequIP/data 2025-01-03T07:20:59,562 copying benchmol/model_pools/geom3d/NequIP/data/AtomicDataDict.py -> build/lib/benchmol/model_pools/geom3d/NequIP/data 2025-01-03T07:20:59,564 copying benchmol/model_pools/geom3d/NequIP/data/transforms.py -> build/lib/benchmol/model_pools/geom3d/NequIP/data 2025-01-03T07:20:59,566 copying benchmol/model_pools/geom3d/NequIP/data/_keys.py -> build/lib/benchmol/model_pools/geom3d/NequIP/data 2025-01-03T07:20:59,568 copying benchmol/model_pools/geom3d/NequIP/data/__init__.py -> build/lib/benchmol/model_pools/geom3d/NequIP/data 2025-01-03T07:20:59,570 copying benchmol/model_pools/geom3d/NequIP/data/dataloader.py -> build/lib/benchmol/model_pools/geom3d/NequIP/data 2025-01-03T07:20:59,572 copying benchmol/model_pools/geom3d/NequIP/data/_build.py -> build/lib/benchmol/model_pools/geom3d/NequIP/data 2025-01-03T07:20:59,574 copying benchmol/model_pools/geom3d/NequIP/data/AtomicData.py -> build/lib/benchmol/model_pools/geom3d/NequIP/data 2025-01-03T07:20:59,577 copying benchmol/model_pools/geom3d/NequIP/data/_util.py -> build/lib/benchmol/model_pools/geom3d/NequIP/data 2025-01-03T07:20:59,579 copying benchmol/model_pools/geom3d/NequIP/data/_test_data.py -> build/lib/benchmol/model_pools/geom3d/NequIP/data 2025-01-03T07:20:59,581 copying benchmol/model_pools/geom3d/NequIP/data/dataset.py -> build/lib/benchmol/model_pools/geom3d/NequIP/data 2025-01-03T07:20:59,585 creating build/lib/benchmol/model_pools/geom3d/NequIP/nn/embedding 2025-01-03T07:20:59,586 copying benchmol/model_pools/geom3d/NequIP/nn/embedding/__init__.py -> build/lib/benchmol/model_pools/geom3d/NequIP/nn/embedding 2025-01-03T07:20:59,588 copying benchmol/model_pools/geom3d/NequIP/nn/embedding/_one_hot.py -> build/lib/benchmol/model_pools/geom3d/NequIP/nn/embedding 2025-01-03T07:20:59,590 copying benchmol/model_pools/geom3d/NequIP/nn/embedding/_edge.py -> build/lib/benchmol/model_pools/geom3d/NequIP/nn/embedding 2025-01-03T07:20:59,592 creating build/lib/benchmol/model_pools/smiles/chembert_helper 2025-01-03T07:20:59,593 copying benchmol/model_pools/smiles/chembert_helper/__init__.py -> build/lib/benchmol/model_pools/smiles/chembert_helper 2025-01-03T07:20:59,595 copying benchmol/model_pools/smiles/chembert_helper/model_component.py -> build/lib/benchmol/model_pools/smiles/chembert_helper 2025-01-03T07:20:59,596 copying benchmol/model_pools/smiles/chembert_helper/dataset.py -> build/lib/benchmol/model_pools/smiles/chembert_helper 2025-01-03T07:20:59,599 creating build/lib/benchmol/model_pools/smiles/molformer_helper 2025-01-03T07:20:59,600 copying benchmol/model_pools/smiles/molformer_helper/__init__.py -> build/lib/benchmol/model_pools/smiles/molformer_helper 2025-01-03T07:20:59,603 creating build/lib/benchmol/data_process/molecules 2025-01-03T07:20:59,604 copying benchmol/data_process/molecules/generate_StructureNet.py -> build/lib/benchmol/data_process/molecules 2025-01-03T07:20:59,606 copying benchmol/data_process/molecules/generate_3d_images_pymol.py -> build/lib/benchmol/data_process/molecules 2025-01-03T07:20:59,609 copying benchmol/data_process/molecules/fingerprints.py -> build/lib/benchmol/data_process/molecules 2025-01-03T07:20:59,611 copying benchmol/data_process/molecules/__init__.py -> build/lib/benchmol/data_process/molecules 2025-01-03T07:20:59,613 copying benchmol/data_process/molecules/generate_3d_graph_data_from_csv.py -> build/lib/benchmol/data_process/molecules 2025-01-03T07:20:59,615 copying benchmol/data_process/molecules/generate_graph_data_from_csv.py -> build/lib/benchmol/data_process/molecules 2025-01-03T07:20:59,617 copying benchmol/data_process/molecules/get_fp_features.py -> build/lib/benchmol/data_process/molecules 2025-01-03T07:20:59,618 copying benchmol/data_process/molecules/generate_images_rdkit.py -> build/lib/benchmol/data_process/molecules 2025-01-03T07:20:59,621 creating build/lib/benchmol/data_process/molecules/graph_helpers 2025-01-03T07:20:59,622 copying benchmol/data_process/molecules/graph_helpers/__init__.py -> build/lib/benchmol/data_process/molecules/graph_helpers 2025-01-03T07:20:59,623 copying benchmol/data_process/molecules/graph_helpers/mol2graph.py -> build/lib/benchmol/data_process/molecules/graph_helpers 2025-01-03T07:20:59,626 copying benchmol/data_process/molecules/graph_helpers/mol2_3dgraph.py -> build/lib/benchmol/data_process/molecules/graph_helpers 2025-01-03T07:20:59,629 creating build/lib/benchmol/data_process/molecules/geometry_helpers 2025-01-03T07:20:59,631 copying benchmol/data_process/molecules/geometry_helpers/data_utils.py -> build/lib/benchmol/data_process/molecules/geometry_helpers 2025-01-03T07:20:59,634 copying benchmol/data_process/molecules/geometry_helpers/__init__.py -> build/lib/benchmol/data_process/molecules/geometry_helpers 2025-01-03T07:20:59,636 creating build/lib/benchmol/data_process/molecules/ogb_helpers 2025-01-03T07:20:59,637 copying benchmol/data_process/molecules/ogb_helpers/__init__.py -> build/lib/benchmol/data_process/molecules/ogb_helpers 2025-01-03T07:20:59,638 copying benchmol/data_process/molecules/ogb_helpers/mol_sdf2_3dgraph.py -> build/lib/benchmol/data_process/molecules/ogb_helpers 2025-01-03T07:20:59,640 copying benchmol/data_process/molecules/ogb_helpers/mol.py -> build/lib/benchmol/data_process/molecules/ogb_helpers 2025-01-03T07:20:59,715 /usr/local/lib/python3.11/dist-packages/setuptools/_distutils/cmd.py:66: SetuptoolsDeprecationWarning: setup.py install is deprecated. 2025-01-03T07:20:59,715 !! 2025-01-03T07:20:59,717 ******************************************************************************** 2025-01-03T07:20:59,717 Please avoid running ``setup.py`` directly. 2025-01-03T07:20:59,718 Instead, use pypa/build, pypa/installer or other 2025-01-03T07:20:59,718 standards-based tools. 2025-01-03T07:20:59,719 See https://blog.ganssle.io/articles/2021/10/setup-py-deprecated.html for details. 2025-01-03T07:20:59,720 ******************************************************************************** 2025-01-03T07:20:59,721 !! 2025-01-03T07:20:59,721 self.initialize_options() 2025-01-03T07:20:59,741 installing to build/bdist.linux-armv7l/wheel 2025-01-03T07:20:59,742 running install 2025-01-03T07:20:59,766 running install_lib 2025-01-03T07:20:59,793 creating build/bdist.linux-armv7l/wheel 2025-01-03T07:20:59,795 creating build/bdist.linux-armv7l/wheel/benchmol 2025-01-03T07:20:59,797 creating build/bdist.linux-armv7l/wheel/benchmol/configs 2025-01-03T07:20:59,798 copying build/lib/benchmol/configs/model_params.py -> build/bdist.linux-armv7l/wheel/./benchmol/configs 2025-01-03T07:20:59,800 copying build/lib/benchmol/configs/__init__.py -> build/bdist.linux-armv7l/wheel/./benchmol/configs 2025-01-03T07:20:59,801 copying build/lib/benchmol/configs/StructureNet_params.py -> build/bdist.linux-armv7l/wheel/./benchmol/configs 2025-01-03T07:20:59,804 creating build/bdist.linux-armv7l/wheel/benchmol/feature_extraction 2025-01-03T07:20:59,805 copying build/lib/benchmol/feature_extraction/feature_extractor.py -> build/bdist.linux-armv7l/wheel/./benchmol/feature_extraction 2025-01-03T07:20:59,808 copying build/lib/benchmol/feature_extraction/__init__.py -> build/bdist.linux-armv7l/wheel/./benchmol/feature_extraction 2025-01-03T07:20:59,810 creating build/bdist.linux-armv7l/wheel/benchmol/trainer 2025-01-03T07:20:59,811 copying build/lib/benchmol/trainer/__init__.py -> build/bdist.linux-armv7l/wheel/./benchmol/trainer 2025-01-03T07:20:59,813 copying build/lib/benchmol/trainer/trainer.py -> build/bdist.linux-armv7l/wheel/./benchmol/trainer 2025-01-03T07:20:59,815 copying build/lib/benchmol/__init__.py -> build/bdist.linux-armv7l/wheel/./benchmol 2025-01-03T07:20:59,818 creating build/bdist.linux-armv7l/wheel/benchmol/metrics 2025-01-03T07:20:59,819 copying build/lib/benchmol/metrics/__init__.py -> build/bdist.linux-armv7l/wheel/./benchmol/metrics 2025-01-03T07:20:59,821 copying build/lib/benchmol/metrics/metric.py -> build/bdist.linux-armv7l/wheel/./benchmol/metrics 2025-01-03T07:20:59,823 creating build/bdist.linux-armv7l/wheel/benchmol/dataloader 2025-01-03T07:20:59,824 copying build/lib/benchmol/dataloader/data_utils.py -> build/bdist.linux-armv7l/wheel/./benchmol/dataloader 2025-01-03T07:20:59,826 copying build/lib/benchmol/dataloader/graph_dataset.py -> build/bdist.linux-armv7l/wheel/./benchmol/dataloader 2025-01-03T07:20:59,828 copying build/lib/benchmol/dataloader/collater.py -> build/bdist.linux-armv7l/wheel/./benchmol/dataloader 2025-01-03T07:20:59,830 copying build/lib/benchmol/dataloader/__init__.py -> build/bdist.linux-armv7l/wheel/./benchmol/dataloader 2025-01-03T07:20:59,831 copying build/lib/benchmol/dataloader/image_dataset.py -> build/bdist.linux-armv7l/wheel/./benchmol/dataloader 2025-01-03T07:20:59,833 copying build/lib/benchmol/dataloader/geometry_dataset.py -> build/bdist.linux-armv7l/wheel/./benchmol/dataloader 2025-01-03T07:20:59,835 copying build/lib/benchmol/dataloader/sequence_dataset.py -> build/bdist.linux-armv7l/wheel/./benchmol/dataloader 2025-01-03T07:20:59,837 copying build/lib/benchmol/dataloader/feat_dataset.py -> build/bdist.linux-armv7l/wheel/./benchmol/dataloader 2025-01-03T07:20:59,840 creating build/bdist.linux-armv7l/wheel/benchmol/model_pools 2025-01-03T07:20:59,842 creating build/bdist.linux-armv7l/wheel/benchmol/model_pools/geom3d 2025-01-03T07:20:59,843 copying build/lib/benchmol/model_pools/geom3d/molecule_gnn_model_simplified.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d 2025-01-03T07:20:59,846 copying build/lib/benchmol/model_pools/geom3d/SphereNet_utils.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d 2025-01-03T07:20:59,848 copying build/lib/benchmol/model_pools/geom3d/molecule_gnn_model.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d 2025-01-03T07:20:59,850 copying build/lib/benchmol/model_pools/geom3d/AWARE.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d 2025-01-03T07:20:59,852 copying build/lib/benchmol/model_pools/geom3d/DimeNetPlusPlus.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d 2025-01-03T07:20:59,854 copying build/lib/benchmol/model_pools/geom3d/GeoSSL_DDM.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d 2025-01-03T07:20:59,856 copying build/lib/benchmol/model_pools/geom3d/CNN.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d 2025-01-03T07:20:59,858 copying build/lib/benchmol/model_pools/geom3d/TFN_utils.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d 2025-01-03T07:20:59,861 creating build/bdist.linux-armv7l/wheel/benchmol/model_pools/geom3d/Equiformer 2025-01-03T07:20:59,862 copying build/lib/benchmol/model_pools/geom3d/Equiformer/radial_func.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/Equiformer 2025-01-03T07:20:59,864 copying build/lib/benchmol/model_pools/geom3d/Equiformer/equiformer_type_01.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/Equiformer 2025-01-03T07:20:59,867 copying build/lib/benchmol/model_pools/geom3d/Equiformer/layer_norm.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/Equiformer 2025-01-03T07:20:59,869 copying build/lib/benchmol/model_pools/geom3d/Equiformer/instance_norm.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/Equiformer 2025-01-03T07:20:59,871 copying build/lib/benchmol/model_pools/geom3d/Equiformer/drop.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/Equiformer 2025-01-03T07:20:59,873 copying build/lib/benchmol/model_pools/geom3d/Equiformer/equiformer_type_0.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/Equiformer 2025-01-03T07:20:59,876 copying build/lib/benchmol/model_pools/geom3d/Equiformer/radial_basis.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/Equiformer 2025-01-03T07:20:59,878 copying build/lib/benchmol/model_pools/geom3d/Equiformer/fast_layer_norm.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/Equiformer 2025-01-03T07:20:59,880 copying build/lib/benchmol/model_pools/geom3d/Equiformer/__init__.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/Equiformer 2025-01-03T07:20:59,882 copying build/lib/benchmol/model_pools/geom3d/Equiformer/expnorm_rbf.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/Equiformer 2025-01-03T07:20:59,884 copying build/lib/benchmol/model_pools/geom3d/Equiformer/equiformer_type_0_periodic.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/Equiformer 2025-01-03T07:20:59,887 copying build/lib/benchmol/model_pools/geom3d/Equiformer/tensor_product_rescale.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/Equiformer 2025-01-03T07:20:59,889 copying build/lib/benchmol/model_pools/geom3d/Equiformer/fast_activation.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/Equiformer 2025-01-03T07:20:59,891 copying build/lib/benchmol/model_pools/geom3d/Equiformer/graph_norm.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/Equiformer 2025-01-03T07:20:59,894 copying build/lib/benchmol/model_pools/geom3d/Equiformer/gaussian_rbf.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/Equiformer 2025-01-03T07:20:59,895 copying build/lib/benchmol/model_pools/geom3d/SE3_Transformer.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d 2025-01-03T07:20:59,897 copying build/lib/benchmol/model_pools/geom3d/BERT.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d 2025-01-03T07:20:59,899 copying build/lib/benchmol/model_pools/geom3d/DimeNet.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d 2025-01-03T07:20:59,901 copying build/lib/benchmol/model_pools/geom3d/SchNet.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d 2025-01-03T07:20:59,903 copying build/lib/benchmol/model_pools/geom3d/AutoEncoder.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d 2025-01-03T07:20:59,906 creating build/bdist.linux-armv7l/wheel/benchmol/model_pools/geom3d/Allegro 2025-01-03T07:20:59,907 creating build/bdist.linux-armv7l/wheel/benchmol/model_pools/geom3d/Allegro/nn 2025-01-03T07:20:59,909 copying build/lib/benchmol/model_pools/geom3d/Allegro/nn/_fc.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/Allegro/nn 2025-01-03T07:20:59,911 copying build/lib/benchmol/model_pools/geom3d/Allegro/nn/cutoffs.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/Allegro/nn 2025-01-03T07:20:59,912 copying build/lib/benchmol/model_pools/geom3d/Allegro/nn/__init__.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/Allegro/nn 2025-01-03T07:20:59,914 copying build/lib/benchmol/model_pools/geom3d/Allegro/nn/_norm_basis.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/Allegro/nn 2025-01-03T07:20:59,916 copying build/lib/benchmol/model_pools/geom3d/Allegro/nn/_allegro.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/Allegro/nn 2025-01-03T07:20:59,919 creating build/bdist.linux-armv7l/wheel/benchmol/model_pools/geom3d/Allegro/nn/_strided 2025-01-03T07:20:59,920 copying build/lib/benchmol/model_pools/geom3d/Allegro/nn/_strided/_spmm.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/Allegro/nn/_strided 2025-01-03T07:20:59,922 copying build/lib/benchmol/model_pools/geom3d/Allegro/nn/_strided/_linear.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/Allegro/nn/_strided 2025-01-03T07:20:59,925 copying build/lib/benchmol/model_pools/geom3d/Allegro/nn/_strided/_layout.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/Allegro/nn/_strided 2025-01-03T07:20:59,926 copying build/lib/benchmol/model_pools/geom3d/Allegro/nn/_strided/__init__.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/Allegro/nn/_strided 2025-01-03T07:20:59,928 copying build/lib/benchmol/model_pools/geom3d/Allegro/nn/_strided/_channels.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/Allegro/nn/_strided 2025-01-03T07:20:59,930 copying build/lib/benchmol/model_pools/geom3d/Allegro/nn/_strided/_contract.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/Allegro/nn/_strided 2025-01-03T07:20:59,932 copying build/lib/benchmol/model_pools/geom3d/Allegro/nn/_edgewise.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/Allegro/nn 2025-01-03T07:20:59,935 copying build/lib/benchmol/model_pools/geom3d/Allegro/_keys.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/Allegro 2025-01-03T07:20:59,937 copying build/lib/benchmol/model_pools/geom3d/Allegro/__init__.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/Allegro 2025-01-03T07:20:59,939 creating build/bdist.linux-armv7l/wheel/benchmol/model_pools/geom3d/Allegro/model 2025-01-03T07:20:59,940 copying build/lib/benchmol/model_pools/geom3d/Allegro/model/__init__.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/Allegro/model 2025-01-03T07:20:59,942 copying build/lib/benchmol/model_pools/geom3d/Allegro/model/Allegro.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/Allegro/model 2025-01-03T07:20:59,944 copying build/lib/benchmol/model_pools/geom3d/__init__.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d 2025-01-03T07:20:59,946 copying build/lib/benchmol/model_pools/geom3d/GPS.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d 2025-01-03T07:20:59,947 copying build/lib/benchmol/model_pools/geom3d/GearNet_layer.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d 2025-01-03T07:20:59,950 creating build/bdist.linux-armv7l/wheel/benchmol/model_pools/geom3d/from_se3cnn 2025-01-03T07:20:59,951 copying build/lib/benchmol/model_pools/geom3d/from_se3cnn/SO3.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/from_se3cnn 2025-01-03T07:20:59,953 copying build/lib/benchmol/model_pools/geom3d/from_se3cnn/representations.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/from_se3cnn 2025-01-03T07:20:59,956 copying build/lib/benchmol/model_pools/geom3d/from_se3cnn/__init__.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/from_se3cnn 2025-01-03T07:20:59,957 copying build/lib/benchmol/model_pools/geom3d/from_se3cnn/utils_steerable.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/from_se3cnn 2025-01-03T07:20:59,959 copying build/lib/benchmol/model_pools/geom3d/from_se3cnn/cache_file.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/from_se3cnn 2025-01-03T07:20:59,962 creating build/bdist.linux-armv7l/wheel/benchmol/model_pools/geom3d/SEGNN 2025-01-03T07:20:59,963 copying build/lib/benchmol/model_pools/geom3d/SEGNN/SEGNN.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/SEGNN 2025-01-03T07:20:59,965 copying build/lib/benchmol/model_pools/geom3d/SEGNN/node_attribute_network.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/SEGNN 2025-01-03T07:20:59,967 copying build/lib/benchmol/model_pools/geom3d/SEGNN/instance_norm.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/SEGNN 2025-01-03T07:20:59,969 copying build/lib/benchmol/model_pools/geom3d/SEGNN/__init__.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/SEGNN 2025-01-03T07:20:59,971 copying build/lib/benchmol/model_pools/geom3d/SEGNN/balanced_irreps.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/SEGNN 2025-01-03T07:20:59,973 copying build/lib/benchmol/model_pools/geom3d/SEGNN/o3_building_blocks.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/SEGNN 2025-01-03T07:20:59,975 copying build/lib/benchmol/model_pools/geom3d/DimeNet_utils.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d 2025-01-03T07:20:59,977 copying build/lib/benchmol/model_pools/geom3d/GEM.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d 2025-01-03T07:20:59,979 copying build/lib/benchmol/model_pools/geom3d/unimol.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d 2025-01-03T07:20:59,981 copying build/lib/benchmol/model_pools/geom3d/EGNN.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d 2025-01-03T07:20:59,983 copying build/lib/benchmol/model_pools/geom3d/SphereNet_periodic.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d 2025-01-03T07:20:59,985 copying build/lib/benchmol/model_pools/geom3d/GVP.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d 2025-01-03T07:20:59,988 copying build/lib/benchmol/model_pools/geom3d/GeoSSL_PDM.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d 2025-01-03T07:20:59,990 copying build/lib/benchmol/model_pools/geom3d/PaiNN_utils.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d 2025-01-03T07:20:59,992 copying build/lib/benchmol/model_pools/geom3d/MLP.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d 2025-01-03T07:20:59,994 copying build/lib/benchmol/model_pools/geom3d/CDConv.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d 2025-01-03T07:20:59,997 creating build/bdist.linux-armv7l/wheel/benchmol/model_pools/geom3d/GemNet 2025-01-03T07:20:59,998 copying build/lib/benchmol/model_pools/geom3d/GemNet/initializers.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/GemNet 2025-01-03T07:21:00,000 copying build/lib/benchmol/model_pools/geom3d/GemNet/__init__.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/GemNet 2025-01-03T07:21:00,002 copying build/lib/benchmol/model_pools/geom3d/GemNet/utils.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/GemNet 2025-01-03T07:21:00,004 copying build/lib/benchmol/model_pools/geom3d/GemNet/GemNet.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/GemNet 2025-01-03T07:21:00,007 copying build/lib/benchmol/model_pools/geom3d/fibers.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d 2025-01-03T07:21:00,009 creating build/bdist.linux-armv7l/wheel/benchmol/model_pools/geom3d/ProNet 2025-01-03T07:21:00,010 copying build/lib/benchmol/model_pools/geom3d/ProNet/ProNet.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/ProNet 2025-01-03T07:21:00,013 copying build/lib/benchmol/model_pools/geom3d/ProNet/__init__.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/ProNet 2025-01-03T07:21:00,015 copying build/lib/benchmol/model_pools/geom3d/ProNet/features.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/ProNet 2025-01-03T07:21:00,017 copying build/lib/benchmol/model_pools/geom3d/SE3_Transformer_utils.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d 2025-01-03T07:21:00,020 creating build/bdist.linux-armv7l/wheel/benchmol/model_pools/geom3d/TransformerM 2025-01-03T07:21:00,022 copying build/lib/benchmol/model_pools/geom3d/TransformerM/transformer_m.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/TransformerM 2025-01-03T07:21:00,024 creating build/bdist.linux-armv7l/wheel/benchmol/model_pools/geom3d/TransformerM/modules 2025-01-03T07:21:00,026 copying build/lib/benchmol/model_pools/geom3d/TransformerM/modules/layer_norm.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/TransformerM/modules 2025-01-03T07:21:00,027 copying build/lib/benchmol/model_pools/geom3d/TransformerM/modules/__init__.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/TransformerM/modules 2025-01-03T07:21:00,029 copying build/lib/benchmol/model_pools/geom3d/TransformerM/modules/droppath.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/TransformerM/modules 2025-01-03T07:21:00,031 copying build/lib/benchmol/model_pools/geom3d/TransformerM/modules/quant_noise.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/TransformerM/modules 2025-01-03T07:21:00,033 copying build/lib/benchmol/model_pools/geom3d/TransformerM/modules/fairseq_dropout.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/TransformerM/modules 2025-01-03T07:21:00,035 copying build/lib/benchmol/model_pools/geom3d/TransformerM/modules/layer_drop.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/TransformerM/modules 2025-01-03T07:21:00,037 copying build/lib/benchmol/model_pools/geom3d/TransformerM/modules/utils.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/TransformerM/modules 2025-01-03T07:21:00,039 copying build/lib/benchmol/model_pools/geom3d/TransformerM/transformer_m_encoder.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/TransformerM 2025-01-03T07:21:00,041 copying build/lib/benchmol/model_pools/geom3d/TransformerM/__init__.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/TransformerM 2025-01-03T07:21:00,043 creating build/bdist.linux-armv7l/wheel/benchmol/model_pools/geom3d/TransformerM/layers 2025-01-03T07:21:00,044 copying build/lib/benchmol/model_pools/geom3d/TransformerM/layers/__init__.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/TransformerM/layers 2025-01-03T07:21:00,046 copying build/lib/benchmol/model_pools/geom3d/TransformerM/layers/transformer_m_encoder_layer.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/TransformerM/layers 2025-01-03T07:21:00,049 copying build/lib/benchmol/model_pools/geom3d/TransformerM/layers/multihead_attention.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/TransformerM/layers 2025-01-03T07:21:00,051 copying build/lib/benchmol/model_pools/geom3d/TransformerM/layers/transformer_m_layers.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/TransformerM/layers 2025-01-03T07:21:00,054 creating build/bdist.linux-armv7l/wheel/benchmol/model_pools/geom3d/Graphormer 2025-01-03T07:21:00,055 copying build/lib/benchmol/model_pools/geom3d/Graphormer/graphormer_graph_encoder.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/Graphormer 2025-01-03T07:21:00,058 creating build/bdist.linux-armv7l/wheel/benchmol/model_pools/geom3d/Graphormer/modules 2025-01-03T07:21:00,059 copying build/lib/benchmol/model_pools/geom3d/Graphormer/modules/layer_norm.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/Graphormer/modules 2025-01-03T07:21:00,061 copying build/lib/benchmol/model_pools/geom3d/Graphormer/modules/__init__.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/Graphormer/modules 2025-01-03T07:21:00,063 copying build/lib/benchmol/model_pools/geom3d/Graphormer/modules/quant_noise.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/Graphormer/modules 2025-01-03T07:21:00,065 copying build/lib/benchmol/model_pools/geom3d/Graphormer/modules/fairseq_dropout.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/Graphormer/modules 2025-01-03T07:21:00,067 copying build/lib/benchmol/model_pools/geom3d/Graphormer/modules/layer_drop.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/Graphormer/modules 2025-01-03T07:21:00,068 copying build/lib/benchmol/model_pools/geom3d/Graphormer/modules/utils.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/Graphormer/modules 2025-01-03T07:21:00,070 copying build/lib/benchmol/model_pools/geom3d/Graphormer/__init__.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/Graphormer 2025-01-03T07:21:00,072 creating build/bdist.linux-armv7l/wheel/benchmol/model_pools/geom3d/Graphormer/layers 2025-01-03T07:21:00,074 copying build/lib/benchmol/model_pools/geom3d/Graphormer/layers/__init__.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/Graphormer/layers 2025-01-03T07:21:00,075 copying build/lib/benchmol/model_pools/geom3d/Graphormer/layers/graphormer_graph_encoder_layer.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/Graphormer/layers 2025-01-03T07:21:00,078 copying build/lib/benchmol/model_pools/geom3d/Graphormer/layers/graphormer_layers.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/Graphormer/layers 2025-01-03T07:21:00,080 copying build/lib/benchmol/model_pools/geom3d/Graphormer/layers/multihead_attention.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/Graphormer/layers 2025-01-03T07:21:00,082 copying build/lib/benchmol/model_pools/geom3d/Graphormer/graphormer.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/Graphormer 2025-01-03T07:21:00,085 copying build/lib/benchmol/model_pools/geom3d/GearNet.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d 2025-01-03T07:21:00,087 copying build/lib/benchmol/model_pools/geom3d/GPS_layer.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d 2025-01-03T07:21:00,089 copying build/lib/benchmol/model_pools/geom3d/DMPNN.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d 2025-01-03T07:21:00,091 copying build/lib/benchmol/model_pools/geom3d/ENN.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d 2025-01-03T07:21:00,093 copying build/lib/benchmol/model_pools/geom3d/ClofNet.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d 2025-01-03T07:21:00,096 creating build/bdist.linux-armv7l/wheel/benchmol/model_pools/geom3d/UniMol 2025-01-03T07:21:00,097 copying build/lib/benchmol/model_pools/geom3d/UniMol/__init__.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/UniMol 2025-01-03T07:21:00,100 creating build/bdist.linux-armv7l/wheel/benchmol/model_pools/geom3d/UniMol/unimol_tools 2025-01-03T07:21:00,101 copying build/lib/benchmol/model_pools/geom3d/UniMol/unimol_tools/predictor.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/UniMol/unimol_tools 2025-01-03T07:21:00,103 creating build/bdist.linux-armv7l/wheel/benchmol/model_pools/geom3d/UniMol/unimol_tools/models 2025-01-03T07:21:00,105 copying build/lib/benchmol/model_pools/geom3d/UniMol/unimol_tools/models/nnmodel.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/UniMol/unimol_tools/models 2025-01-03T07:21:00,107 copying build/lib/benchmol/model_pools/geom3d/UniMol/unimol_tools/models/loss.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/UniMol/unimol_tools/models 2025-01-03T07:21:00,109 copying build/lib/benchmol/model_pools/geom3d/UniMol/unimol_tools/models/__init__.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/UniMol/unimol_tools/models 2025-01-03T07:21:00,111 copying build/lib/benchmol/model_pools/geom3d/UniMol/unimol_tools/models/unimol.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/UniMol/unimol_tools/models 2025-01-03T07:21:00,113 copying build/lib/benchmol/model_pools/geom3d/UniMol/unimol_tools/models/transformers.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/UniMol/unimol_tools/models 2025-01-03T07:21:00,116 creating build/bdist.linux-armv7l/wheel/benchmol/model_pools/geom3d/UniMol/unimol_tools/tasks 2025-01-03T07:21:00,117 copying build/lib/benchmol/model_pools/geom3d/UniMol/unimol_tools/tasks/split.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/UniMol/unimol_tools/tasks 2025-01-03T07:21:00,119 copying build/lib/benchmol/model_pools/geom3d/UniMol/unimol_tools/tasks/__init__.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/UniMol/unimol_tools/tasks 2025-01-03T07:21:00,121 copying build/lib/benchmol/model_pools/geom3d/UniMol/unimol_tools/tasks/trainer.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/UniMol/unimol_tools/tasks 2025-01-03T07:21:00,123 copying build/lib/benchmol/model_pools/geom3d/UniMol/unimol_tools/__init__.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/UniMol/unimol_tools 2025-01-03T07:21:00,126 creating build/bdist.linux-armv7l/wheel/benchmol/model_pools/geom3d/UniMol/unimol_tools/config 2025-01-03T07:21:00,127 copying build/lib/benchmol/model_pools/geom3d/UniMol/unimol_tools/config/__init__.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/UniMol/unimol_tools/config 2025-01-03T07:21:00,129 copying build/lib/benchmol/model_pools/geom3d/UniMol/unimol_tools/config/model_config.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/UniMol/unimol_tools/config 2025-01-03T07:21:00,130 copying build/lib/benchmol/model_pools/geom3d/UniMol/unimol_tools/predict.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/UniMol/unimol_tools 2025-01-03T07:21:00,133 creating build/bdist.linux-armv7l/wheel/benchmol/model_pools/geom3d/UniMol/unimol_tools/weights 2025-01-03T07:21:00,135 copying build/lib/benchmol/model_pools/geom3d/UniMol/unimol_tools/weights/__init__.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/UniMol/unimol_tools/weights 2025-01-03T07:21:00,136 copying build/lib/benchmol/model_pools/geom3d/UniMol/unimol_tools/weights/weighthub.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/UniMol/unimol_tools/weights 2025-01-03T07:21:00,138 copying build/lib/benchmol/model_pools/geom3d/UniMol/unimol_tools/train.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/UniMol/unimol_tools 2025-01-03T07:21:00,141 creating build/bdist.linux-armv7l/wheel/benchmol/model_pools/geom3d/UniMol/unimol_tools/utils 2025-01-03T07:21:00,142 copying build/lib/benchmol/model_pools/geom3d/UniMol/unimol_tools/utils/config_handler.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/UniMol/unimol_tools/utils 2025-01-03T07:21:00,144 copying build/lib/benchmol/model_pools/geom3d/UniMol/unimol_tools/utils/util.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/UniMol/unimol_tools/utils 2025-01-03T07:21:00,146 copying build/lib/benchmol/model_pools/geom3d/UniMol/unimol_tools/utils/__init__.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/UniMol/unimol_tools/utils 2025-01-03T07:21:00,148 copying build/lib/benchmol/model_pools/geom3d/UniMol/unimol_tools/utils/metrics.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/UniMol/unimol_tools/utils 2025-01-03T07:21:00,150 copying build/lib/benchmol/model_pools/geom3d/UniMol/unimol_tools/utils/base_logger.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/UniMol/unimol_tools/utils 2025-01-03T07:21:00,152 creating build/bdist.linux-armv7l/wheel/benchmol/model_pools/geom3d/UniMol/unimol_tools/data 2025-01-03T07:21:00,154 copying build/lib/benchmol/model_pools/geom3d/UniMol/unimol_tools/data/datascaler.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/UniMol/unimol_tools/data 2025-01-03T07:21:00,156 copying build/lib/benchmol/model_pools/geom3d/UniMol/unimol_tools/data/__init__.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/UniMol/unimol_tools/data 2025-01-03T07:21:00,157 copying build/lib/benchmol/model_pools/geom3d/UniMol/unimol_tools/data/dictionary.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/UniMol/unimol_tools/data 2025-01-03T07:21:00,160 copying build/lib/benchmol/model_pools/geom3d/UniMol/unimol_tools/data/datahub.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/UniMol/unimol_tools/data 2025-01-03T07:21:00,162 copying build/lib/benchmol/model_pools/geom3d/UniMol/unimol_tools/data/datareader.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/UniMol/unimol_tools/data 2025-01-03T07:21:00,164 copying build/lib/benchmol/model_pools/geom3d/UniMol/unimol_tools/data/conformer.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/UniMol/unimol_tools/data 2025-01-03T07:21:00,166 copying build/lib/benchmol/model_pools/geom3d/SphereNet.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d 2025-01-03T07:21:00,169 copying build/lib/benchmol/model_pools/geom3d/TFN.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d 2025-01-03T07:21:00,172 creating build/bdist.linux-armv7l/wheel/benchmol/model_pools/geom3d/PNA 2025-01-03T07:21:00,173 copying build/lib/benchmol/model_pools/geom3d/PNA/__init__.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/PNA 2025-01-03T07:21:00,174 copying build/lib/benchmol/model_pools/geom3d/PNA/aggregators.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/PNA 2025-01-03T07:21:00,176 copying build/lib/benchmol/model_pools/geom3d/PNA/PNA.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/PNA 2025-01-03T07:21:00,179 copying build/lib/benchmol/model_pools/geom3d/PNA/scalers.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/PNA 2025-01-03T07:21:00,181 copying build/lib/benchmol/model_pools/geom3d/PaiNN.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d 2025-01-03T07:21:00,183 copying build/lib/benchmol/model_pools/geom3d/utils.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d 2025-01-03T07:21:00,186 creating build/bdist.linux-armv7l/wheel/benchmol/model_pools/geom3d/NequIP 2025-01-03T07:21:00,187 creating build/bdist.linux-armv7l/wheel/benchmol/model_pools/geom3d/NequIP/nn 2025-01-03T07:21:00,189 copying build/lib/benchmol/model_pools/geom3d/NequIP/nn/_interaction_block.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/NequIP/nn 2025-01-03T07:21:00,191 copying build/lib/benchmol/model_pools/geom3d/NequIP/nn/_grad_output.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/NequIP/nn 2025-01-03T07:21:00,193 copying build/lib/benchmol/model_pools/geom3d/NequIP/nn/cutoffs.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/NequIP/nn 2025-01-03T07:21:00,195 copying build/lib/benchmol/model_pools/geom3d/NequIP/nn/_rescale.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/NequIP/nn 2025-01-03T07:21:00,197 copying build/lib/benchmol/model_pools/geom3d/NequIP/nn/radial_basis.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/NequIP/nn 2025-01-03T07:21:00,199 copying build/lib/benchmol/model_pools/geom3d/NequIP/nn/__init__.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/NequIP/nn 2025-01-03T07:21:00,201 copying build/lib/benchmol/model_pools/geom3d/NequIP/nn/_convnetlayer.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/NequIP/nn 2025-01-03T07:21:00,203 copying build/lib/benchmol/model_pools/geom3d/NequIP/nn/_concat.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/NequIP/nn 2025-01-03T07:21:00,205 creating build/bdist.linux-armv7l/wheel/benchmol/model_pools/geom3d/NequIP/nn/embedding 2025-01-03T07:21:00,207 copying build/lib/benchmol/model_pools/geom3d/NequIP/nn/embedding/__init__.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/NequIP/nn/embedding 2025-01-03T07:21:00,208 copying build/lib/benchmol/model_pools/geom3d/NequIP/nn/embedding/_one_hot.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/NequIP/nn/embedding 2025-01-03T07:21:00,210 copying build/lib/benchmol/model_pools/geom3d/NequIP/nn/embedding/_edge.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/NequIP/nn/embedding 2025-01-03T07:21:00,212 copying build/lib/benchmol/model_pools/geom3d/NequIP/nn/_graph_mixin.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/NequIP/nn 2025-01-03T07:21:00,214 copying build/lib/benchmol/model_pools/geom3d/NequIP/nn/_util.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/NequIP/nn 2025-01-03T07:21:00,216 copying build/lib/benchmol/model_pools/geom3d/NequIP/nn/nonlinearities.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/NequIP/nn 2025-01-03T07:21:00,218 copying build/lib/benchmol/model_pools/geom3d/NequIP/nn/_atomwise.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/NequIP/nn 2025-01-03T07:21:00,220 copying build/lib/benchmol/model_pools/geom3d/NequIP/__init__.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/NequIP 2025-01-03T07:21:00,222 creating build/bdist.linux-armv7l/wheel/benchmol/model_pools/geom3d/NequIP/scripts 2025-01-03T07:21:00,223 copying build/lib/benchmol/model_pools/geom3d/NequIP/scripts/run_md.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/NequIP/scripts 2025-01-03T07:21:00,226 copying build/lib/benchmol/model_pools/geom3d/NequIP/scripts/__init__.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/NequIP/scripts 2025-01-03T07:21:00,228 copying build/lib/benchmol/model_pools/geom3d/NequIP/scripts/deploy.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/NequIP/scripts 2025-01-03T07:21:00,230 copying build/lib/benchmol/model_pools/geom3d/NequIP/scripts/train.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/NequIP/scripts 2025-01-03T07:21:00,232 copying build/lib/benchmol/model_pools/geom3d/NequIP/scripts/benchmark.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/NequIP/scripts 2025-01-03T07:21:00,234 copying build/lib/benchmol/model_pools/geom3d/NequIP/scripts/_logger.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/NequIP/scripts 2025-01-03T07:21:00,236 copying build/lib/benchmol/model_pools/geom3d/NequIP/scripts/evaluate.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/NequIP/scripts 2025-01-03T07:21:00,239 creating build/bdist.linux-armv7l/wheel/benchmol/model_pools/geom3d/NequIP/utils 2025-01-03T07:21:00,241 copying build/lib/benchmol/model_pools/geom3d/NequIP/utils/wandb.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/NequIP/utils 2025-01-03T07:21:00,243 copying build/lib/benchmol/model_pools/geom3d/NequIP/utils/modules.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/NequIP/utils 2025-01-03T07:21:00,244 copying build/lib/benchmol/model_pools/geom3d/NequIP/utils/scatter.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/NequIP/utils 2025-01-03T07:21:00,246 copying build/lib/benchmol/model_pools/geom3d/NequIP/utils/test.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/NequIP/utils 2025-01-03T07:21:00,248 copying build/lib/benchmol/model_pools/geom3d/NequIP/utils/auto_init.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/NequIP/utils 2025-01-03T07:21:00,251 copying build/lib/benchmol/model_pools/geom3d/NequIP/utils/tp_utils.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/NequIP/utils 2025-01-03T07:21:00,252 copying build/lib/benchmol/model_pools/geom3d/NequIP/utils/config.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/NequIP/utils 2025-01-03T07:21:00,254 copying build/lib/benchmol/model_pools/geom3d/NequIP/utils/versions.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/NequIP/utils 2025-01-03T07:21:00,256 copying build/lib/benchmol/model_pools/geom3d/NequIP/utils/__init__.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/NequIP/utils 2025-01-03T07:21:00,258 copying build/lib/benchmol/model_pools/geom3d/NequIP/utils/git.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/NequIP/utils 2025-01-03T07:21:00,260 copying build/lib/benchmol/model_pools/geom3d/NequIP/utils/_global_options.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/NequIP/utils 2025-01-03T07:21:00,262 copying build/lib/benchmol/model_pools/geom3d/NequIP/utils/output.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/NequIP/utils 2025-01-03T07:21:00,264 copying build/lib/benchmol/model_pools/geom3d/NequIP/utils/multiprocessing.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/NequIP/utils 2025-01-03T07:21:00,265 copying build/lib/benchmol/model_pools/geom3d/NequIP/utils/regressor.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/NequIP/utils 2025-01-03T07:21:00,268 copying build/lib/benchmol/model_pools/geom3d/NequIP/utils/savenload.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/NequIP/utils 2025-01-03T07:21:00,270 copying build/lib/benchmol/model_pools/geom3d/NequIP/utils/misc.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/NequIP/utils 2025-01-03T07:21:00,272 copying build/lib/benchmol/model_pools/geom3d/NequIP/utils/batch_ops.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/NequIP/utils 2025-01-03T07:21:00,274 creating build/bdist.linux-armv7l/wheel/benchmol/model_pools/geom3d/NequIP/model 2025-01-03T07:21:00,275 copying build/lib/benchmol/model_pools/geom3d/NequIP/model/_weight_init.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/NequIP/model 2025-01-03T07:21:00,278 copying build/lib/benchmol/model_pools/geom3d/NequIP/model/_scaling.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/NequIP/model 2025-01-03T07:21:00,280 copying build/lib/benchmol/model_pools/geom3d/NequIP/model/__init__.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/NequIP/model 2025-01-03T07:21:00,282 copying build/lib/benchmol/model_pools/geom3d/NequIP/model/_build.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/NequIP/model 2025-01-03T07:21:00,284 copying build/lib/benchmol/model_pools/geom3d/NequIP/model/_eng.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/NequIP/model 2025-01-03T07:21:00,286 copying build/lib/benchmol/model_pools/geom3d/NequIP/model/_grads.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/NequIP/model 2025-01-03T07:21:00,287 copying build/lib/benchmol/model_pools/geom3d/NequIP/model/builder_utils.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/NequIP/model 2025-01-03T07:21:00,290 creating build/bdist.linux-armv7l/wheel/benchmol/model_pools/geom3d/NequIP/data 2025-01-03T07:21:00,291 copying build/lib/benchmol/model_pools/geom3d/NequIP/data/AtomicDataDict.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/NequIP/data 2025-01-03T07:21:00,293 copying build/lib/benchmol/model_pools/geom3d/NequIP/data/transforms.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/NequIP/data 2025-01-03T07:21:00,295 copying build/lib/benchmol/model_pools/geom3d/NequIP/data/_keys.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/NequIP/data 2025-01-03T07:21:00,297 copying build/lib/benchmol/model_pools/geom3d/NequIP/data/__init__.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/NequIP/data 2025-01-03T07:21:00,299 copying build/lib/benchmol/model_pools/geom3d/NequIP/data/dataloader.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/NequIP/data 2025-01-03T07:21:00,300 copying build/lib/benchmol/model_pools/geom3d/NequIP/data/_build.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/NequIP/data 2025-01-03T07:21:00,303 copying build/lib/benchmol/model_pools/geom3d/NequIP/data/AtomicData.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/NequIP/data 2025-01-03T07:21:00,305 copying build/lib/benchmol/model_pools/geom3d/NequIP/data/_util.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/NequIP/data 2025-01-03T07:21:00,307 copying build/lib/benchmol/model_pools/geom3d/NequIP/data/_test_data.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/NequIP/data 2025-01-03T07:21:00,309 copying build/lib/benchmol/model_pools/geom3d/NequIP/data/dataset.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/geom3d/NequIP/data 2025-01-03T07:21:00,312 creating build/bdist.linux-armv7l/wheel/benchmol/model_pools/image 2025-01-03T07:21:00,313 copying build/lib/benchmol/model_pools/image/__init__.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/image 2025-01-03T07:21:00,315 copying build/lib/benchmol/model_pools/__init__.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools 2025-01-03T07:21:00,317 creating build/bdist.linux-armv7l/wheel/benchmol/model_pools/graph 2025-01-03T07:21:00,318 copying build/lib/benchmol/model_pools/graph/gnns_graphmvp_helper.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/graph 2025-01-03T07:21:00,321 copying build/lib/benchmol/model_pools/graph/gnns_molebert.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/graph 2025-01-03T07:21:00,323 copying build/lib/benchmol/model_pools/graph/deepergcn.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/graph 2025-01-03T07:21:00,326 copying build/lib/benchmol/model_pools/graph/gnns.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/graph 2025-01-03T07:21:00,328 copying build/lib/benchmol/model_pools/graph/__init__.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/graph 2025-01-03T07:21:00,330 copying build/lib/benchmol/model_pools/graph/cgip.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/graph 2025-01-03T07:21:00,331 copying build/lib/benchmol/model_pools/graph/cgip_helper.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/graph 2025-01-03T07:21:00,333 copying build/lib/benchmol/model_pools/graph/gnns_graphmvp.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/graph 2025-01-03T07:21:00,336 copying build/lib/benchmol/model_pools/image_factory.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools 2025-01-03T07:21:00,338 copying build/lib/benchmol/model_pools/geometry_factory.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools 2025-01-03T07:21:00,341 copying build/lib/benchmol/model_pools/smiles_factory.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools 2025-01-03T07:21:00,343 copying build/lib/benchmol/model_pools/base_utils.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools 2025-01-03T07:21:00,345 creating build/bdist.linux-armv7l/wheel/benchmol/model_pools/smiles 2025-01-03T07:21:00,347 creating build/bdist.linux-armv7l/wheel/benchmol/model_pools/smiles/chembert_helper 2025-01-03T07:21:00,349 copying build/lib/benchmol/model_pools/smiles/chembert_helper/__init__.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/smiles/chembert_helper 2025-01-03T07:21:00,350 copying build/lib/benchmol/model_pools/smiles/chembert_helper/model_component.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/smiles/chembert_helper 2025-01-03T07:21:00,352 copying build/lib/benchmol/model_pools/smiles/chembert_helper/dataset.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/smiles/chembert_helper 2025-01-03T07:21:00,354 copying build/lib/benchmol/model_pools/smiles/chembert.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/smiles 2025-01-03T07:21:00,357 creating build/bdist.linux-armv7l/wheel/benchmol/model_pools/smiles/molformer_helper 2025-01-03T07:21:00,358 copying build/lib/benchmol/model_pools/smiles/molformer_helper/__init__.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/smiles/molformer_helper 2025-01-03T07:21:00,359 copying build/lib/benchmol/model_pools/smiles/__init__.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/smiles 2025-01-03T07:21:00,361 copying build/lib/benchmol/model_pools/smiles/molformer.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/smiles 2025-01-03T07:21:00,363 copying build/lib/benchmol/model_pools/smiles/abc_smiles.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools/smiles 2025-01-03T07:21:00,365 copying build/lib/benchmol/model_pools/graph_factory.py -> build/bdist.linux-armv7l/wheel/./benchmol/model_pools 2025-01-03T07:21:00,367 creating build/bdist.linux-armv7l/wheel/benchmol/utils 2025-01-03T07:21:00,368 copying build/lib/benchmol/utils/graph_utils.py -> build/bdist.linux-armv7l/wheel/./benchmol/utils 2025-01-03T07:21:00,371 copying build/lib/benchmol/utils/__init__.py -> build/bdist.linux-armv7l/wheel/./benchmol/utils 2025-01-03T07:21:00,372 copying build/lib/benchmol/utils/public_utils.py -> build/bdist.linux-armv7l/wheel/./benchmol/utils 2025-01-03T07:21:00,374 copying build/lib/benchmol/utils/splitter.py -> build/bdist.linux-armv7l/wheel/./benchmol/utils 2025-01-03T07:21:00,376 copying build/lib/benchmol/utils/logger.py -> build/bdist.linux-armv7l/wheel/./benchmol/utils 2025-01-03T07:21:00,378 copying build/lib/benchmol/utils/evaluate.py -> build/bdist.linux-armv7l/wheel/./benchmol/utils 2025-01-03T07:21:00,381 creating build/bdist.linux-armv7l/wheel/benchmol/data_process 2025-01-03T07:21:00,382 copying build/lib/benchmol/data_process/__init__.py -> build/bdist.linux-armv7l/wheel/./benchmol/data_process 2025-01-03T07:21:00,384 creating build/bdist.linux-armv7l/wheel/benchmol/data_process/molecules 2025-01-03T07:21:00,385 copying build/lib/benchmol/data_process/molecules/generate_StructureNet.py -> build/bdist.linux-armv7l/wheel/./benchmol/data_process/molecules 2025-01-03T07:21:00,387 copying build/lib/benchmol/data_process/molecules/generate_3d_images_pymol.py -> build/bdist.linux-armv7l/wheel/./benchmol/data_process/molecules 2025-01-03T07:21:00,390 copying build/lib/benchmol/data_process/molecules/fingerprints.py -> build/bdist.linux-armv7l/wheel/./benchmol/data_process/molecules 2025-01-03T07:21:00,392 copying build/lib/benchmol/data_process/molecules/__init__.py -> build/bdist.linux-armv7l/wheel/./benchmol/data_process/molecules 2025-01-03T07:21:00,394 copying build/lib/benchmol/data_process/molecules/generate_3d_graph_data_from_csv.py -> build/bdist.linux-armv7l/wheel/./benchmol/data_process/molecules 2025-01-03T07:21:00,397 creating build/bdist.linux-armv7l/wheel/benchmol/data_process/molecules/graph_helpers 2025-01-03T07:21:00,398 copying build/lib/benchmol/data_process/molecules/graph_helpers/__init__.py -> build/bdist.linux-armv7l/wheel/./benchmol/data_process/molecules/graph_helpers 2025-01-03T07:21:00,400 copying build/lib/benchmol/data_process/molecules/graph_helpers/mol2graph.py -> build/bdist.linux-armv7l/wheel/./benchmol/data_process/molecules/graph_helpers 2025-01-03T07:21:00,402 copying build/lib/benchmol/data_process/molecules/graph_helpers/mol2_3dgraph.py -> build/bdist.linux-armv7l/wheel/./benchmol/data_process/molecules/graph_helpers 2025-01-03T07:21:00,405 creating build/bdist.linux-armv7l/wheel/benchmol/data_process/molecules/geometry_helpers 2025-01-03T07:21:00,407 copying build/lib/benchmol/data_process/molecules/geometry_helpers/data_utils.py -> build/bdist.linux-armv7l/wheel/./benchmol/data_process/molecules/geometry_helpers 2025-01-03T07:21:00,409 copying build/lib/benchmol/data_process/molecules/geometry_helpers/__init__.py -> build/bdist.linux-armv7l/wheel/./benchmol/data_process/molecules/geometry_helpers 2025-01-03T07:21:00,411 creating build/bdist.linux-armv7l/wheel/benchmol/data_process/molecules/ogb_helpers 2025-01-03T07:21:00,412 copying build/lib/benchmol/data_process/molecules/ogb_helpers/__init__.py -> build/bdist.linux-armv7l/wheel/./benchmol/data_process/molecules/ogb_helpers 2025-01-03T07:21:00,414 copying build/lib/benchmol/data_process/molecules/ogb_helpers/mol_sdf2_3dgraph.py -> build/bdist.linux-armv7l/wheel/./benchmol/data_process/molecules/ogb_helpers 2025-01-03T07:21:00,415 copying build/lib/benchmol/data_process/molecules/ogb_helpers/mol.py -> build/bdist.linux-armv7l/wheel/./benchmol/data_process/molecules/ogb_helpers 2025-01-03T07:21:00,417 copying build/lib/benchmol/data_process/molecules/generate_graph_data_from_csv.py -> build/bdist.linux-armv7l/wheel/./benchmol/data_process/molecules 2025-01-03T07:21:00,419 copying build/lib/benchmol/data_process/molecules/get_fp_features.py -> build/bdist.linux-armv7l/wheel/./benchmol/data_process/molecules 2025-01-03T07:21:00,421 copying build/lib/benchmol/data_process/molecules/generate_images_rdkit.py -> build/bdist.linux-armv7l/wheel/./benchmol/data_process/molecules 2025-01-03T07:21:00,423 running install_egg_info 2025-01-03T07:21:00,456 running egg_info 2025-01-03T07:21:00,482 writing benchmol.egg-info/PKG-INFO 2025-01-03T07:21:00,485 writing dependency_links to benchmol.egg-info/dependency_links.txt 2025-01-03T07:21:00,487 writing top-level names to benchmol.egg-info/top_level.txt 2025-01-03T07:21:00,561 reading manifest file 'benchmol.egg-info/SOURCES.txt' 2025-01-03T07:21:00,594 writing manifest file 'benchmol.egg-info/SOURCES.txt' 2025-01-03T07:21:00,595 Copying benchmol.egg-info to build/bdist.linux-armv7l/wheel/./benchmol-0.0.2-py3.11.egg-info 2025-01-03T07:21:00,605 running install_scripts 2025-01-03T07:21:00,616 creating build/bdist.linux-armv7l/wheel/benchmol-0.0.2.dist-info/WHEEL 2025-01-03T07:21:00,618 creating '/tmp/pip-wheel-em90j3bo/benchmol-0.0.2-py3-none-any.whl' and adding 'build/bdist.linux-armv7l/wheel' to it 2025-01-03T07:21:00,620 adding 'benchmol/__init__.py' 2025-01-03T07:21:00,622 adding 'benchmol/configs/StructureNet_params.py' 2025-01-03T07:21:00,623 adding 'benchmol/configs/__init__.py' 2025-01-03T07:21:00,625 adding 'benchmol/configs/model_params.py' 2025-01-03T07:21:00,626 adding 'benchmol/data_process/__init__.py' 2025-01-03T07:21:00,628 adding 'benchmol/data_process/molecules/__init__.py' 2025-01-03T07:21:00,630 adding 'benchmol/data_process/molecules/fingerprints.py' 2025-01-03T07:21:00,631 adding 'benchmol/data_process/molecules/generate_3d_graph_data_from_csv.py' 2025-01-03T07:21:00,634 adding 'benchmol/data_process/molecules/generate_3d_images_pymol.py' 2025-01-03T07:21:00,636 adding 'benchmol/data_process/molecules/generate_StructureNet.py' 2025-01-03T07:21:00,638 adding 'benchmol/data_process/molecules/generate_graph_data_from_csv.py' 2025-01-03T07:21:00,639 adding 'benchmol/data_process/molecules/generate_images_rdkit.py' 2025-01-03T07:21:00,640 adding 'benchmol/data_process/molecules/get_fp_features.py' 2025-01-03T07:21:00,642 adding 'benchmol/data_process/molecules/geometry_helpers/__init__.py' 2025-01-03T07:21:00,646 adding 'benchmol/data_process/molecules/geometry_helpers/data_utils.py' 2025-01-03T07:21:00,648 adding 'benchmol/data_process/molecules/graph_helpers/__init__.py' 2025-01-03T07:21:00,650 adding 'benchmol/data_process/molecules/graph_helpers/mol2_3dgraph.py' 2025-01-03T07:21:00,652 adding 'benchmol/data_process/molecules/graph_helpers/mol2graph.py' 2025-01-03T07:21:00,654 adding 'benchmol/data_process/molecules/ogb_helpers/__init__.py' 2025-01-03T07:21:00,655 adding 'benchmol/data_process/molecules/ogb_helpers/mol.py' 2025-01-03T07:21:00,656 adding 'benchmol/data_process/molecules/ogb_helpers/mol_sdf2_3dgraph.py' 2025-01-03T07:21:00,658 adding 'benchmol/dataloader/__init__.py' 2025-01-03T07:21:00,659 adding 'benchmol/dataloader/collater.py' 2025-01-03T07:21:00,660 adding 'benchmol/dataloader/data_utils.py' 2025-01-03T07:21:00,662 adding 'benchmol/dataloader/feat_dataset.py' 2025-01-03T07:21:00,663 adding 'benchmol/dataloader/geometry_dataset.py' 2025-01-03T07:21:00,664 adding 'benchmol/dataloader/graph_dataset.py' 2025-01-03T07:21:00,666 adding 'benchmol/dataloader/image_dataset.py' 2025-01-03T07:21:00,667 adding 'benchmol/dataloader/sequence_dataset.py' 2025-01-03T07:21:00,669 adding 'benchmol/feature_extraction/__init__.py' 2025-01-03T07:21:00,671 adding 'benchmol/feature_extraction/feature_extractor.py' 2025-01-03T07:21:00,672 adding 'benchmol/metrics/__init__.py' 2025-01-03T07:21:00,674 adding 'benchmol/metrics/metric.py' 2025-01-03T07:21:00,675 adding 'benchmol/model_pools/__init__.py' 2025-01-03T07:21:00,677 adding 'benchmol/model_pools/base_utils.py' 2025-01-03T07:21:00,679 adding 'benchmol/model_pools/geometry_factory.py' 2025-01-03T07:21:00,680 adding 'benchmol/model_pools/graph_factory.py' 2025-01-03T07:21:00,682 adding 'benchmol/model_pools/image_factory.py' 2025-01-03T07:21:00,684 adding 'benchmol/model_pools/smiles_factory.py' 2025-01-03T07:21:00,686 adding 'benchmol/model_pools/geom3d/AWARE.py' 2025-01-03T07:21:00,688 adding 'benchmol/model_pools/geom3d/AutoEncoder.py' 2025-01-03T07:21:00,689 adding 'benchmol/model_pools/geom3d/BERT.py' 2025-01-03T07:21:00,691 adding 'benchmol/model_pools/geom3d/CDConv.py' 2025-01-03T07:21:00,692 adding 'benchmol/model_pools/geom3d/CNN.py' 2025-01-03T07:21:00,695 adding 'benchmol/model_pools/geom3d/ClofNet.py' 2025-01-03T07:21:00,696 adding 'benchmol/model_pools/geom3d/DMPNN.py' 2025-01-03T07:21:00,698 adding 'benchmol/model_pools/geom3d/DimeNet.py' 2025-01-03T07:21:00,700 adding 'benchmol/model_pools/geom3d/DimeNetPlusPlus.py' 2025-01-03T07:21:00,701 adding 'benchmol/model_pools/geom3d/DimeNet_utils.py' 2025-01-03T07:21:00,703 adding 'benchmol/model_pools/geom3d/EGNN.py' 2025-01-03T07:21:00,705 adding 'benchmol/model_pools/geom3d/ENN.py' 2025-01-03T07:21:00,706 adding 'benchmol/model_pools/geom3d/GEM.py' 2025-01-03T07:21:00,708 adding 'benchmol/model_pools/geom3d/GPS.py' 2025-01-03T07:21:00,709 adding 'benchmol/model_pools/geom3d/GPS_layer.py' 2025-01-03T07:21:00,712 adding 'benchmol/model_pools/geom3d/GVP.py' 2025-01-03T07:21:00,713 adding 'benchmol/model_pools/geom3d/GearNet.py' 2025-01-03T07:21:00,715 adding 'benchmol/model_pools/geom3d/GearNet_layer.py' 2025-01-03T07:21:00,717 adding 'benchmol/model_pools/geom3d/GeoSSL_DDM.py' 2025-01-03T07:21:00,718 adding 'benchmol/model_pools/geom3d/GeoSSL_PDM.py' 2025-01-03T07:21:00,719 adding 'benchmol/model_pools/geom3d/MLP.py' 2025-01-03T07:21:00,721 adding 'benchmol/model_pools/geom3d/PaiNN.py' 2025-01-03T07:21:00,723 adding 'benchmol/model_pools/geom3d/PaiNN_utils.py' 2025-01-03T07:21:00,724 adding 'benchmol/model_pools/geom3d/SE3_Transformer.py' 2025-01-03T07:21:00,727 adding 'benchmol/model_pools/geom3d/SE3_Transformer_utils.py' 2025-01-03T07:21:00,728 adding 'benchmol/model_pools/geom3d/SchNet.py' 2025-01-03T07:21:00,731 adding 'benchmol/model_pools/geom3d/SphereNet.py' 2025-01-03T07:21:00,733 adding 'benchmol/model_pools/geom3d/SphereNet_periodic.py' 2025-01-03T07:21:00,735 adding 'benchmol/model_pools/geom3d/SphereNet_utils.py' 2025-01-03T07:21:00,736 adding 'benchmol/model_pools/geom3d/TFN.py' 2025-01-03T07:21:00,738 adding 'benchmol/model_pools/geom3d/TFN_utils.py' 2025-01-03T07:21:00,739 adding 'benchmol/model_pools/geom3d/__init__.py' 2025-01-03T07:21:00,741 adding 'benchmol/model_pools/geom3d/fibers.py' 2025-01-03T07:21:00,742 adding 'benchmol/model_pools/geom3d/molecule_gnn_model.py' 2025-01-03T07:21:00,744 adding 'benchmol/model_pools/geom3d/molecule_gnn_model_simplified.py' 2025-01-03T07:21:00,745 adding 'benchmol/model_pools/geom3d/unimol.py' 2025-01-03T07:21:00,746 adding 'benchmol/model_pools/geom3d/utils.py' 2025-01-03T07:21:00,748 adding 'benchmol/model_pools/geom3d/Allegro/__init__.py' 2025-01-03T07:21:00,749 adding 'benchmol/model_pools/geom3d/Allegro/_keys.py' 2025-01-03T07:21:00,751 adding 'benchmol/model_pools/geom3d/Allegro/model/Allegro.py' 2025-01-03T07:21:00,752 adding 'benchmol/model_pools/geom3d/Allegro/model/__init__.py' 2025-01-03T07:21:00,754 adding 'benchmol/model_pools/geom3d/Allegro/nn/__init__.py' 2025-01-03T07:21:00,757 adding 'benchmol/model_pools/geom3d/Allegro/nn/_allegro.py' 2025-01-03T07:21:00,758 adding 'benchmol/model_pools/geom3d/Allegro/nn/_edgewise.py' 2025-01-03T07:21:00,760 adding 'benchmol/model_pools/geom3d/Allegro/nn/_fc.py' 2025-01-03T07:21:00,761 adding 'benchmol/model_pools/geom3d/Allegro/nn/_norm_basis.py' 2025-01-03T07:21:00,762 adding 'benchmol/model_pools/geom3d/Allegro/nn/cutoffs.py' 2025-01-03T07:21:00,764 adding 'benchmol/model_pools/geom3d/Allegro/nn/_strided/__init__.py' 2025-01-03T07:21:00,765 adding 'benchmol/model_pools/geom3d/Allegro/nn/_strided/_channels.py' 2025-01-03T07:21:00,768 adding 'benchmol/model_pools/geom3d/Allegro/nn/_strided/_contract.py' 2025-01-03T07:21:00,769 adding 'benchmol/model_pools/geom3d/Allegro/nn/_strided/_layout.py' 2025-01-03T07:21:00,771 adding 'benchmol/model_pools/geom3d/Allegro/nn/_strided/_linear.py' 2025-01-03T07:21:00,773 adding 'benchmol/model_pools/geom3d/Allegro/nn/_strided/_spmm.py' 2025-01-03T07:21:00,774 adding 'benchmol/model_pools/geom3d/Equiformer/__init__.py' 2025-01-03T07:21:00,776 adding 'benchmol/model_pools/geom3d/Equiformer/drop.py' 2025-01-03T07:21:00,780 adding 'benchmol/model_pools/geom3d/Equiformer/equiformer_type_0.py' 2025-01-03T07:21:00,782 adding 'benchmol/model_pools/geom3d/Equiformer/equiformer_type_01.py' 2025-01-03T07:21:00,786 adding 'benchmol/model_pools/geom3d/Equiformer/equiformer_type_0_periodic.py' 2025-01-03T07:21:00,788 adding 'benchmol/model_pools/geom3d/Equiformer/expnorm_rbf.py' 2025-01-03T07:21:00,789 adding 'benchmol/model_pools/geom3d/Equiformer/fast_activation.py' 2025-01-03T07:21:00,791 adding 'benchmol/model_pools/geom3d/Equiformer/fast_layer_norm.py' 2025-01-03T07:21:00,792 adding 'benchmol/model_pools/geom3d/Equiformer/gaussian_rbf.py' 2025-01-03T07:21:00,794 adding 'benchmol/model_pools/geom3d/Equiformer/graph_norm.py' 2025-01-03T07:21:00,795 adding 'benchmol/model_pools/geom3d/Equiformer/instance_norm.py' 2025-01-03T07:21:00,797 adding 'benchmol/model_pools/geom3d/Equiformer/layer_norm.py' 2025-01-03T07:21:00,799 adding 'benchmol/model_pools/geom3d/Equiformer/radial_basis.py' 2025-01-03T07:21:00,800 adding 'benchmol/model_pools/geom3d/Equiformer/radial_func.py' 2025-01-03T07:21:00,802 adding 'benchmol/model_pools/geom3d/Equiformer/tensor_product_rescale.py' 2025-01-03T07:21:00,806 adding 'benchmol/model_pools/geom3d/GemNet/GemNet.py' 2025-01-03T07:21:00,807 adding 'benchmol/model_pools/geom3d/GemNet/__init__.py' 2025-01-03T07:21:00,808 adding 'benchmol/model_pools/geom3d/GemNet/initializers.py' 2025-01-03T07:21:00,809 adding 'benchmol/model_pools/geom3d/GemNet/utils.py' 2025-01-03T07:21:00,811 adding 'benchmol/model_pools/geom3d/Graphormer/__init__.py' 2025-01-03T07:21:00,813 adding 'benchmol/model_pools/geom3d/Graphormer/graphormer.py' 2025-01-03T07:21:00,815 adding 'benchmol/model_pools/geom3d/Graphormer/graphormer_graph_encoder.py' 2025-01-03T07:21:00,816 adding 'benchmol/model_pools/geom3d/Graphormer/layers/__init__.py' 2025-01-03T07:21:00,818 adding 'benchmol/model_pools/geom3d/Graphormer/layers/graphormer_graph_encoder_layer.py' 2025-01-03T07:21:00,820 adding 'benchmol/model_pools/geom3d/Graphormer/layers/graphormer_layers.py' 2025-01-03T07:21:00,821 adding 'benchmol/model_pools/geom3d/Graphormer/layers/multihead_attention.py' 2025-01-03T07:21:00,823 adding 'benchmol/model_pools/geom3d/Graphormer/modules/__init__.py' 2025-01-03T07:21:00,824 adding 'benchmol/model_pools/geom3d/Graphormer/modules/fairseq_dropout.py' 2025-01-03T07:21:00,826 adding 'benchmol/model_pools/geom3d/Graphormer/modules/layer_drop.py' 2025-01-03T07:21:00,827 adding 'benchmol/model_pools/geom3d/Graphormer/modules/layer_norm.py' 2025-01-03T07:21:00,828 adding 'benchmol/model_pools/geom3d/Graphormer/modules/quant_noise.py' 2025-01-03T07:21:00,829 adding 'benchmol/model_pools/geom3d/Graphormer/modules/utils.py' 2025-01-03T07:21:00,831 adding 'benchmol/model_pools/geom3d/NequIP/__init__.py' 2025-01-03T07:21:00,835 adding 'benchmol/model_pools/geom3d/NequIP/data/AtomicData.py' 2025-01-03T07:21:00,837 adding 'benchmol/model_pools/geom3d/NequIP/data/AtomicDataDict.py' 2025-01-03T07:21:00,838 adding 'benchmol/model_pools/geom3d/NequIP/data/__init__.py' 2025-01-03T07:21:00,840 adding 'benchmol/model_pools/geom3d/NequIP/data/_build.py' 2025-01-03T07:21:00,841 adding 'benchmol/model_pools/geom3d/NequIP/data/_keys.py' 2025-01-03T07:21:00,843 adding 'benchmol/model_pools/geom3d/NequIP/data/_test_data.py' 2025-01-03T07:21:00,844 adding 'benchmol/model_pools/geom3d/NequIP/data/_util.py' 2025-01-03T07:21:00,845 adding 'benchmol/model_pools/geom3d/NequIP/data/dataloader.py' 2025-01-03T07:21:00,850 adding 'benchmol/model_pools/geom3d/NequIP/data/dataset.py' 2025-01-03T07:21:00,852 adding 'benchmol/model_pools/geom3d/NequIP/data/transforms.py' 2025-01-03T07:21:00,854 adding 'benchmol/model_pools/geom3d/NequIP/model/__init__.py' 2025-01-03T07:21:00,855 adding 'benchmol/model_pools/geom3d/NequIP/model/_build.py' 2025-01-03T07:21:00,857 adding 'benchmol/model_pools/geom3d/NequIP/model/_eng.py' 2025-01-03T07:21:00,858 adding 'benchmol/model_pools/geom3d/NequIP/model/_grads.py' 2025-01-03T07:21:00,860 adding 'benchmol/model_pools/geom3d/NequIP/model/_scaling.py' 2025-01-03T07:21:00,862 adding 'benchmol/model_pools/geom3d/NequIP/model/_weight_init.py' 2025-01-03T07:21:00,863 adding 'benchmol/model_pools/geom3d/NequIP/model/builder_utils.py' 2025-01-03T07:21:00,865 adding 'benchmol/model_pools/geom3d/NequIP/nn/__init__.py' 2025-01-03T07:21:00,867 adding 'benchmol/model_pools/geom3d/NequIP/nn/_atomwise.py' 2025-01-03T07:21:00,868 adding 'benchmol/model_pools/geom3d/NequIP/nn/_concat.py' 2025-01-03T07:21:00,869 adding 'benchmol/model_pools/geom3d/NequIP/nn/_convnetlayer.py' 2025-01-03T07:21:00,872 adding 'benchmol/model_pools/geom3d/NequIP/nn/_grad_output.py' 2025-01-03T07:21:00,874 adding 'benchmol/model_pools/geom3d/NequIP/nn/_graph_mixin.py' 2025-01-03T07:21:00,875 adding 'benchmol/model_pools/geom3d/NequIP/nn/_interaction_block.py' 2025-01-03T07:21:00,877 adding 'benchmol/model_pools/geom3d/NequIP/nn/_rescale.py' 2025-01-03T07:21:00,879 adding 'benchmol/model_pools/geom3d/NequIP/nn/_util.py' 2025-01-03T07:21:00,880 adding 'benchmol/model_pools/geom3d/NequIP/nn/cutoffs.py' 2025-01-03T07:21:00,881 adding 'benchmol/model_pools/geom3d/NequIP/nn/nonlinearities.py' 2025-01-03T07:21:00,883 adding 'benchmol/model_pools/geom3d/NequIP/nn/radial_basis.py' 2025-01-03T07:21:00,884 adding 'benchmol/model_pools/geom3d/NequIP/nn/embedding/__init__.py' 2025-01-03T07:21:00,885 adding 'benchmol/model_pools/geom3d/NequIP/nn/embedding/_edge.py' 2025-01-03T07:21:00,887 adding 'benchmol/model_pools/geom3d/NequIP/nn/embedding/_one_hot.py' 2025-01-03T07:21:00,888 adding 'benchmol/model_pools/geom3d/NequIP/scripts/__init__.py' 2025-01-03T07:21:00,890 adding 'benchmol/model_pools/geom3d/NequIP/scripts/_logger.py' 2025-01-03T07:21:00,891 adding 'benchmol/model_pools/geom3d/NequIP/scripts/benchmark.py' 2025-01-03T07:21:00,893 adding 'benchmol/model_pools/geom3d/NequIP/scripts/deploy.py' 2025-01-03T07:21:00,896 adding 'benchmol/model_pools/geom3d/NequIP/scripts/evaluate.py' 2025-01-03T07:21:00,898 adding 'benchmol/model_pools/geom3d/NequIP/scripts/run_md.py' 2025-01-03T07:21:00,899 adding 'benchmol/model_pools/geom3d/NequIP/scripts/train.py' 2025-01-03T07:21:00,901 adding 'benchmol/model_pools/geom3d/NequIP/utils/__init__.py' 2025-01-03T07:21:00,903 adding 'benchmol/model_pools/geom3d/NequIP/utils/_global_options.py' 2025-01-03T07:21:00,905 adding 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2025-01-03T07:21:00,923 adding 'benchmol/model_pools/geom3d/NequIP/utils/tp_utils.py' 2025-01-03T07:21:00,925 adding 'benchmol/model_pools/geom3d/NequIP/utils/versions.py' 2025-01-03T07:21:00,926 adding 'benchmol/model_pools/geom3d/NequIP/utils/wandb.py' 2025-01-03T07:21:00,928 adding 'benchmol/model_pools/geom3d/PNA/PNA.py' 2025-01-03T07:21:00,930 adding 'benchmol/model_pools/geom3d/PNA/__init__.py' 2025-01-03T07:21:00,931 adding 'benchmol/model_pools/geom3d/PNA/aggregators.py' 2025-01-03T07:21:00,932 adding 'benchmol/model_pools/geom3d/PNA/scalers.py' 2025-01-03T07:21:00,935 adding 'benchmol/model_pools/geom3d/ProNet/ProNet.py' 2025-01-03T07:21:00,936 adding 'benchmol/model_pools/geom3d/ProNet/__init__.py' 2025-01-03T07:21:00,938 adding 'benchmol/model_pools/geom3d/ProNet/features.py' 2025-01-03T07:21:00,941 adding 'benchmol/model_pools/geom3d/SEGNN/SEGNN.py' 2025-01-03T07:21:00,942 adding 'benchmol/model_pools/geom3d/SEGNN/__init__.py' 2025-01-03T07:21:00,943 adding 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'benchmol/model_pools/geom3d/UniMol/unimol_tools/predict.py' 2025-01-03T07:21:00,977 adding 'benchmol/model_pools/geom3d/UniMol/unimol_tools/predictor.py' 2025-01-03T07:21:00,979 adding 'benchmol/model_pools/geom3d/UniMol/unimol_tools/train.py' 2025-01-03T07:21:00,981 adding 'benchmol/model_pools/geom3d/UniMol/unimol_tools/config/__init__.py' 2025-01-03T07:21:00,982 adding 'benchmol/model_pools/geom3d/UniMol/unimol_tools/config/model_config.py' 2025-01-03T07:21:00,984 adding 'benchmol/model_pools/geom3d/UniMol/unimol_tools/data/__init__.py' 2025-01-03T07:21:00,986 adding 'benchmol/model_pools/geom3d/UniMol/unimol_tools/data/conformer.py' 2025-01-03T07:21:00,987 adding 'benchmol/model_pools/geom3d/UniMol/unimol_tools/data/datahub.py' 2025-01-03T07:21:00,989 adding 'benchmol/model_pools/geom3d/UniMol/unimol_tools/data/datareader.py' 2025-01-03T07:21:00,991 adding 'benchmol/model_pools/geom3d/UniMol/unimol_tools/data/datascaler.py' 2025-01-03T07:21:00,992 adding 'benchmol/model_pools/geom3d/UniMol/unimol_tools/data/dictionary.py' 2025-01-03T07:21:00,994 adding 'benchmol/model_pools/geom3d/UniMol/unimol_tools/models/__init__.py' 2025-01-03T07:21:00,996 adding 'benchmol/model_pools/geom3d/UniMol/unimol_tools/models/loss.py' 2025-01-03T07:21:00,999 adding 'benchmol/model_pools/geom3d/UniMol/unimol_tools/models/nnmodel.py' 2025-01-03T07:21:01,001 adding 'benchmol/model_pools/geom3d/UniMol/unimol_tools/models/transformers.py' 2025-01-03T07:21:01,004 adding 'benchmol/model_pools/geom3d/UniMol/unimol_tools/models/unimol.py' 2025-01-03T07:21:01,006 adding 'benchmol/model_pools/geom3d/UniMol/unimol_tools/tasks/__init__.py' 2025-01-03T07:21:01,007 adding 'benchmol/model_pools/geom3d/UniMol/unimol_tools/tasks/split.py' 2025-01-03T07:21:01,010 adding 'benchmol/model_pools/geom3d/UniMol/unimol_tools/tasks/trainer.py' 2025-01-03T07:21:01,012 adding 'benchmol/model_pools/geom3d/UniMol/unimol_tools/utils/__init__.py' 2025-01-03T07:21:01,013 adding 'benchmol/model_pools/geom3d/UniMol/unimol_tools/utils/base_logger.py' 2025-01-03T07:21:01,015 adding 'benchmol/model_pools/geom3d/UniMol/unimol_tools/utils/config_handler.py' 2025-01-03T07:21:01,016 adding 'benchmol/model_pools/geom3d/UniMol/unimol_tools/utils/metrics.py' 2025-01-03T07:21:01,018 adding 'benchmol/model_pools/geom3d/UniMol/unimol_tools/utils/util.py' 2025-01-03T07:21:01,020 adding 'benchmol/model_pools/geom3d/UniMol/unimol_tools/weights/__init__.py' 2025-01-03T07:21:01,021 adding 'benchmol/model_pools/geom3d/UniMol/unimol_tools/weights/weighthub.py' 2025-01-03T07:21:01,023 adding 'benchmol/model_pools/geom3d/from_se3cnn/SO3.py' 2025-01-03T07:21:01,024 adding 'benchmol/model_pools/geom3d/from_se3cnn/__init__.py' 2025-01-03T07:21:01,026 adding 'benchmol/model_pools/geom3d/from_se3cnn/cache_file.py' 2025-01-03T07:21:01,028 adding 'benchmol/model_pools/geom3d/from_se3cnn/representations.py' 2025-01-03T07:21:01,030 adding 'benchmol/model_pools/geom3d/from_se3cnn/utils_steerable.py' 2025-01-03T07:21:01,032 adding 'benchmol/model_pools/graph/__init__.py' 2025-01-03T07:21:01,034 adding 'benchmol/model_pools/graph/cgip.py' 2025-01-03T07:21:01,036 adding 'benchmol/model_pools/graph/cgip_helper.py' 2025-01-03T07:21:01,038 adding 'benchmol/model_pools/graph/deepergcn.py' 2025-01-03T07:21:01,041 adding 'benchmol/model_pools/graph/gnns.py' 2025-01-03T07:21:01,043 adding 'benchmol/model_pools/graph/gnns_graphmvp.py' 2025-01-03T07:21:01,045 adding 'benchmol/model_pools/graph/gnns_graphmvp_helper.py' 2025-01-03T07:21:01,048 adding 'benchmol/model_pools/graph/gnns_molebert.py' 2025-01-03T07:21:01,050 adding 'benchmol/model_pools/image/__init__.py' 2025-01-03T07:21:01,052 adding 'benchmol/model_pools/smiles/__init__.py' 2025-01-03T07:21:01,053 adding 'benchmol/model_pools/smiles/abc_smiles.py' 2025-01-03T07:21:01,055 adding 'benchmol/model_pools/smiles/chembert.py' 2025-01-03T07:21:01,057 adding 'benchmol/model_pools/smiles/molformer.py' 2025-01-03T07:21:01,059 adding 'benchmol/model_pools/smiles/chembert_helper/__init__.py' 2025-01-03T07:21:01,061 adding 'benchmol/model_pools/smiles/chembert_helper/dataset.py' 2025-01-03T07:21:01,063 adding 'benchmol/model_pools/smiles/chembert_helper/model_component.py' 2025-01-03T07:21:01,064 adding 'benchmol/model_pools/smiles/molformer_helper/__init__.py' 2025-01-03T07:21:01,066 adding 'benchmol/trainer/__init__.py' 2025-01-03T07:21:01,068 adding 'benchmol/trainer/trainer.py' 2025-01-03T07:21:01,070 adding 'benchmol/utils/__init__.py' 2025-01-03T07:21:01,072 adding 'benchmol/utils/evaluate.py' 2025-01-03T07:21:01,075 adding 'benchmol/utils/graph_utils.py' 2025-01-03T07:21:01,077 adding 'benchmol/utils/logger.py' 2025-01-03T07:21:01,078 adding 'benchmol/utils/public_utils.py' 2025-01-03T07:21:01,081 adding 'benchmol/utils/splitter.py' 2025-01-03T07:21:01,083 adding 'benchmol-0.0.2.dist-info/METADATA' 2025-01-03T07:21:01,085 adding 'benchmol-0.0.2.dist-info/WHEEL' 2025-01-03T07:21:01,086 adding 'benchmol-0.0.2.dist-info/top_level.txt' 2025-01-03T07:21:01,091 adding 'benchmol-0.0.2.dist-info/RECORD' 2025-01-03T07:21:01,101 removing build/bdist.linux-armv7l/wheel 2025-01-03T07:21:01,279 Building wheel for benchmol (setup.py): finished with status 'done' 2025-01-03T07:21:01,286 Created wheel for benchmol: filename=benchmol-0.0.2-py3-none-any.whl size=467257 sha256=6251effdc2cb9d73b76f74d9bd39f3fc1ed01276da6ff8730f79061770822b38 2025-01-03T07:21:01,288 Stored in directory: /tmp/pip-ephem-wheel-cache-xva92e_k/wheels/3f/9a/59/3cd8739ad6a5f4af92fe152b42322fd2c31fe467a5c6468512 2025-01-03T07:21:01,305 Successfully built benchmol 2025-01-03T07:21:01,319 Removed build tracker: '/tmp/pip-build-tracker-agh7v33u'