A project (and object) for storing, manipulating, and converting molecular mechanics data.
status-active role-library lang-python task-file-io entity-small-molecule interface-api status-published status-packaged-pypi status-packaged-conda method-physics domain-molecular-simulation scope-suite task-system-model task-forcefield ecosystem-openff ecosystem-openmm
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Updated
Jul 27, 2026 - Python