[gmx-users] Martini force field for inhibitors

Sridhar Kumar Kannam srisriphy at gmail.com
Fri Aug 29 02:03:14 CEST 2014

Dear Gromacs users,

I have very recently started working with  Gromacs and Martini force field.
I am able to generate the coarse-grained model for HIV Protease (1hvr.pdb).
I want to simulate the protein along with its inhibitor. Are there any
guidelines for building (coarse-graining) its inhibitor ?

Sorry for the naive question ...

Thank you.

Cheers !!!
Sridhar  Kumar Kannam :)

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