OpenFF Sage 2.2.0 3 Replicates
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HMR, 0.9 rvdw, 0.8 switch, 300K. Trajectories have been modified to remove the first 100 ns, remove PBC jumps, center the system, and make molecules whole.
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2025-03-11
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HMR, 0.9 rvdw, 0.8 switch, 300K. Trajectories have been modified to remove the first 100 ns, remove PBC jumps, center the system, and make molecules whole.