piwheels

rxnfp

chemical reaction fingerprints

Installation

In a virtualenv (see these instructions if you need to create one):

pip3 install rxnfp

Dependencies

• faerun
• torch
• matplotlib
• transformers
• scikit-learn
• scipy

Releases

Version	Released	Bookworm Python 3.11	Trixie Python 3.13	Files
0.1.0	2021-08-12
rxnfp-0.1.0-py3-none-any.whl (71 MB)
0.0.9	2021-05-28
rxnfp-0.0.9-py3-none-any.whl (71 MB)
0.0.8	2020-12-03
rxnfp-0.0.8-py3-none-any.whl (71 MB)
0.0.7	2020-10-06
rxnfp-0.0.7-py3-none-any.whl (71 MB)
0.0.6	2020-09-02
rxnfp-0.0.6-py3-none-any.whl (71 MB)
0.0.5	2020-09-02
rxnfp-0.0.5-py3-none-any.whl (71 MB)
0.0.4	2020-07-09
rxnfp-0.0.4-py3-none-any.whl (71 MB)
0.0.3	2020-07-09
rxnfp-0.0.3-py3-none-any.whl (10 KB)
0.0.2	2020-07-09
rxnfp-0.0.2-py3-none-any.whl (10 KB)
0.0.1	2020-07-09
rxnfp-0.0.1-py3-none-any.whl (10 KB)

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