2 results found Sort:

SSAGESproject
SSAGES SSAGESproject
29
86
gpl-3.0
16
Software Suite for Advanced General Ensemble Simulations
qbox lammps miccom gromacs hoomd-blue enhanced-sampling collective-variables scientific-machine-learning
Created 2016-09-30
1,435 commits to release-0.9 branch, last one 3 years ago
SSAGESLabs
PySAGES SSAGESLabs
26
75
other
8
Python Suite for Advanced General Ensemble Simulations
ase jax miccom openmm python pysages hoomd-blue gpu-support hacktoberfest enhanced-sampling collective-variables scientific-machine-learning
Created 2020-09-05
577 commits to main branch, last one about a month ago