kcfconvoy
KCF-Convoy: efficient Python package to convert KCF chemical substructure fingerprints
Installation
In a virtualenv (see these instructions if you need to create one):
pip3 install kcfconvoy
Dependencies
- ipython
- pandas
- prompt-toolkit
- kiwisolver
- nbformat
- entrypoints
- cryptography-vectors
- six
- olefile
- nbconvert
- cython
- mkl-random
- defusedxml
- idna
- pytz
- conda
- networkx
- cryptography
- html5lib
- jinja2
- certifi
- pexpect
- pycparser
- webencodings
- matplotlib
- chardet
- scipy
- tornado
- notebook
- jedi
- simplegeneric
- send2trash
- ipykernel
- scikit-learn
- terminado
- cffi
- parso
- qtconsole
- ruamel-yaml
- pyparsing
- jupyter-core
- pillow
- numpy
- pyopenssl
- traitlets
- asn1crypto
- ptyprocess
- pysocks
- ipython-genutils
- testpath
- backcall
- jupyter-console
- jupyter-client
- prometheus-client
- bleach
- cycler
- pyzmq
- urllib3
- decorator
- markupsafe
- jupyter
- jsonschema
- pycosat
- python-dateutil
- pygments
- requests
- wcwidth
- widgetsnbextension
- pandocfilters
- pickleshare
- ipywidgets
- mistune
Releases
| Version | Released | Bullseye Python 3.9 |
Bookworm Python 3.11 |
Trixie Python 3.13 |
Files |
|---|---|---|---|---|---|
| 0.0.5 | 2019-12-02 | ||||
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| 0.0.4 | 2018-10-15 | ||||
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| 0.0.3 | 2018-01-02 | ||||
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| 0.0.2 | 2018-01-02 | ||||
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