PyPI page
Author:
Jannik Buhr
License:
GPL-3.0
Summary:
Reaction plugin for KIMMDY that hydrolyses peptide bonds
Latest version:
0.5.1
Required dependencies:
freesasa
|
kimmdy
|
mdanalysis
Optional dependencies:
black
|
grappa-ff
|
griffe
|
jupyter
|
kimmdy-grappa
|
numpy
|
pandas
|
plotnine
|
pytest
|
pytest-cov
|
quartodoc
|
statsmodels
|
torch
|
tox
|
tox-uv
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