PyPI page
Author:
Oliver Beckstein
Summary:
Generation of conformers of small molecules.
Latest version:
0.3.0a1
Required dependencies:
gromacswrapper
|
mdanalysis
|
numpy
|
pyedr
|
rdkit
|
tqdm
Optional dependencies:
pytest
|
pytest-cov
|
pytest-xdist
|
sphinx
|
sphinx-rtd-theme
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