PyPI page
Home page
Author:
Erik Henning Thiede, Pilar Cossio, Roy Lederman
License:
MIT License
Copyright (c) 2023 David Silva-Sánchez
Permission is hereby granted, free of charge, to any person obtaining a copy
of this software and associate...
Summary:
Cryo-EM Ensemble Optimization using JAX and OpenMM for Molecular Dynamics simulations.
Latest version:
0.2.2
Required dependencies:
cryojax
|
cryospax
|
dm-pix
|
equinox
|
jax
|
jax-dataloader
|
jaxlib
|
jaxopt
|
jaxtyping
|
mdtraj
|
natsort
|
numpy
|
openmm
|
optax
|
optimistix
|
pydantic
|
pyyaml
|
tqdm
Optional dependencies:
pre-commit
|
pytest
|
ruff
Downloads last day:
13
Downloads last week:
44
Downloads last month:
166