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graeter-group / kimmdy

Reactive MD pipeline for GROMACS using Kinetic Monte Carlo / Molecular Dynamics (KIMMDY)
https://graeter-group.github.io/kimmdy/
GNU General Public License v3.0
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add additional torsion dihedrals from aminoacids.rtp and ffbonded #100

Open jmbuhr opened 1 year ago

KRiedmiller commented 1 year ago

Status?