[gmx-users] solvent-exclusion model for implicit solvent

didymos tomek.wlodarski at gmail.com
Wed Feb 5 19:55:15 CET 2014

Dear All,

I was wondering if there is possible to implement Gaussian solvent-exclusion
model (EEF1, Lazaridis, T.; Karplus, M. Proteins: Struct., Funct., Bioinf.
1999, 35, 133−152.), which is implemented in CHARMM, into GROMASC?


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