implicit solvent has apparently been implemented in the openMM
modification of gromacs, although that is still in beta and is not to
be trusted for production runs without doing your own testing. I have
not tried it myself.
You can obtain it here:
https://simtk.org/home/openmm
-- original message --
Can I use implicit solvent in a MD simulations on gromacs?
How can I do it?
Thanks for your help!!!
Deisy Y. Rodriguez S.
Practicante de Computos Avanzados
Grupo de Investigacion en Fisicoquimica Teorica y Experimental GIFTEX
Tel. 6344000 ext. 2792
Universidad Industrial de Santander
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