[gmx-users] atom charge in new residue

[Maximiliano Figueroa]

Hi. I am created a new residue for OPLS, but I have a problem, I don't
have a charge for each atom. I believe that the charge must be
calculated with RESP, and with de basis HF/631 G**, but, is that
true?. If yes, somebody know a server that can calculate this partial
charge in each atom at a new resiue?

Thanks