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Author:
None
Summary:
WESTPA is a package for constructing and running stochastic simulations using the "weighted ensemble" approach of Huber and Kim (1996).
Latest version:
2022.15
Required dependencies:
blessings
|
h5py
|
ipykernel
|
matplotlib
|
mdtraj
|
numpy
|
pandas
|
pyyaml
|
pyzmq
|
scipy
|
tables
|
tqdm
Optional dependencies:
mpi4py
|
pre-commit
|
pytest
|
pytest-cov
|
pytest-rerunfailures
|
pytest-timeout
|
westpa
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