Package Usage: conda: openpathsampling-cli

OpenPathSampling (OPS) is a powerful Python library for path sampling simulations. The openpathsampling-cli package provides a useful command line interface for working with OPS files and for running OPS simulations.
6 versions
Latest release: about 3 years ago

View more package details: https://packages.ecosyste.ms/registries/anaconda.org/packages/openpathsampling-cli

View more repository details: https://repos.ecosyste.ms/hosts/GitHub/repositories/openpathsampling%2Fopenpathsampling-cli

Dependent Repos 1

openpathsampling/ops_tutorial

Introductory tutorial on TPS, committor analysis, and (MS)TIS with OpenPathSampling

• binder/environment.yml

Size: 28.7 MB - Last synced: 3 months ago - Pushed: 5 months ago