[gmx-users] FEP source code

[Carsten Kutzner]

a

grep -rl -e "FEP" -e "dvdlambda" *

in the gromacs source directory will show you these files.

Carsten


On Apr 24, 2009, at 4:33 PM, murat cetinkaya wrote:

> Hello GMX-people
>
> I am trying to locate the source code files regarding free energy  
> perturbation (FEP) calculations. Does anyone have an idea?
>
> regards,
>
> -- 
> Murat Cetinkaya, PhD
>
> Max-Planck-Institute for Metals Research
> Protein Mechanics and Evolution Group
> Bioquant BQ0031, Universitaet Heidelberg
> INF 267, 69120 Heidelberg, Germany
> Tel +49 6221-54-51268 Fax +49 6221-54-51483
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--
Dr. Carsten Kutzner
Max Planck Institute for Biophysical Chemistry
Theoretical and Computational Biophysics
Am Fassberg 11, 37077 Goettingen, Germany
Tel. +49-551-2012313, Fax: +49-551-2012302
http://www.mpibpc.mpg.de/home/grubmueller/ihp/ckutzne