Adaptive Force Matching

Automatic force field optimization. Given a force field and a set of reference data (e.g. energies and forces from QM calculations, experimental measurements), we tune the force field parameters such that it accurately reproduces the reference data.
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Orion Cohen
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Joined: Wed Jun 10, 2020 8:49 am

Adaptive Force Matching

Post by Orion Cohen » Wed Jun 10, 2020 8:50 am

Does Force Balance support the Adaptive Force Matching algorithm? If so, are there any examples of the AFM algorithm being implemented?

Thank you,

Orion

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