/tools/openff-interchange
openff-interchange
openforcefield/openff-interchange
summary
OpenFF Interchange is a project designed for storing and manipulating parametrized chemical systems, facilitating interoperability between different molecular simulation software. It provides APIs for exporting molecular data to common formats, supporting various force fields and chemical topologies.
description
A project (and object) for storing, manipulating, and converting molecular mechanics data.
topics
amberforcefieldgromacsinteroperabilitylammpsmolecular-simulationopenmm
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