[gmx-users] How to get ligand top file for oplsaa?

Rui Li moonfine at mail.sdu.edu.cn
Tue Jul 3 05:58:30 CEST 2007

Dear all,
I have a ligand molecule, and I want to get its opls all-atom force field topology
file. How can I get it?
I don't know how to establish the atom types and the charge of the ligand.
Any reply will be appreciated.

Rui Li

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