Ecosyste.ms: Packages

An open API service providing package, version and dependency metadata of many open source software ecosystems and registries.

conda-forge.org "molecular dynamics" keyword

hiphive 0.7.1
hiPhive is a tool for efficiently extracting high-order force constants from atomistic simulation...
5 versions - Latest release: almost 4 years ago - 24 stars on GitLab.com
maicos 0.6.1
MAICoS is an object-oriented python toolkit for analysing the structure and dynamics of interfaci...
2 versions - Latest release: over 1 year ago - 12 stars on GitLab.com
gromacs 2022.3
GROMACS is a versatile package to perform molecular dynamics, i.e. simulate the Newtonian equatio...
4 versions - Latest release: over 1 year ago - 24 dependent repositories - 77 stars on GitLab.com