Dear Amber users,
I’m wondering if it is possible to run CpHMD-pHREX in AMBER 14 for the organic polymer with -COOH functional group. I see that leaprc.constph is mostly set up for amino acids and since I am dealing with non-standard residues , how do I go about it ?
Any help is appreciated.
Thanks,
Ashar
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Received on Tue Mar 24 2015 - 11:00:03 PDT
