[gmx-users] Software for ESP fitting

Vasilii Artyukhov darth.vasya at gmail.com
Mon Sep 8 11:36:18 CEST 2008


Hi gmx-users,

Sorry for a not-strictly-GROMACS-related question, but could someone suggest
a program I could use to fit atomic charges to quantum chemistry results?

Thanks in advance,
Vasilii
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