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Author:
João Correia
License:
GPL-3.0 license
Summary:
ReactEA: Combining Evolutionary Algorithms with Reaction Rules Towards Focused Molecular Design
Latest version:
1.0.0
Required dependencies:
chembl_structure_pipeline
|
click
|
cytoolz
|
jmetalpy
|
joblib
|
matplotlib
|
networkx
|
numpy
|
pandas
|
pyyaml
|
rdkit-pypi
Optional dependencies:
flake8
|
mypy
|
pytest
|
pytest-cov
|
tox
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