New issue

Have a question about this project? Sign up for a free GitHub account to open an issue and contact its maintainers and the community.

Sign up for GitHub

By clicking “Sign up for GitHub”, you agree to our terms of service and privacy statement. We’ll occasionally send you account related emails.

Already on GitHub? Sign in to your account

Jump to bottom

Missing parameters in Gromacs a99SBdisp.ff #3

Open

rongfengzou opened this issue Feb 25, 2021 · 1 comment

rongfengzou commented Feb 25, 2021

Missing Improper Dih. types

CT CC CW NA

which is used for HIS.

jsaulhf commented Nov 24, 2023

I have the same problem when histidine is protonated in delta and epsilon (HIP). Did you manage to solve this?

Sign up for free to join this conversation on GitHub. Already have an account? Sign in to comment