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License:
Apache License Version 2.0, January 2004 http://www.apache.org/licenses/ TERMS AND CONDITIONS FOR USE, REPRODUCTION, AND DISTRIBUTION 1. Definitions. "License" shall mean the terms and conditions f...
Summary:
moldrug is a python package for drug-oriented optimization on the chemical space.
Latest version:
3.7.3
Required dependencies:
crem
|
dill
|
meeko
|
numpy
|
pandas
|
pyyaml
|
rdkit
|
scipy
|
six
|
tqdm
Optional dependencies:
pytest
|
requests
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