[AMBER] Adding atom types to gaff.dat

From: Sam Walsworth (Researcher) <"Sam>
Date: Sat, 18 Dec 2021 05:50:00 +0000


I'm keen to develop a new atom type for Ag+ (bonded). Can this be done by adding it to the MOD4 section of gaff.dat if I have correct Rmin/2 and epsilon values, or is there issues with this method?

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Received on Fri Dec 17 2021 - 22:00:02 PST
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