[gmx-users] Files for CHARMM 27 force field

David van der Spoel spoel at xray.bmc.uu.se
Wed May 17 13:23:28 CEST 2006


Shaul Wallach wrote:
> Last October, Dr. Yuguang Mu reported that he uploaded files for the CHARMM
> 27
> force field to the GROMACS site at
> 
> http://www.gromacs.org/topologies/force_fields.php

We're still busy moving to the new site. Apparently this file slipped 
through. You can find it however under 
http://www.gromacs.org/old/topologies/force_fields.php

> 
> Later, in December, Dmitry mentioned the file ffcharmm-n.tdb. However, the
> link above
> doesn't seem to exist any more, and I don't see any files for the CHARMM
> force field among
> the user contributions to the force field topologies on the GROMACS site
> (under Downloads).
> 
> Does anyone know where the CHARMM 27 force field files for GROMACS may be
> obtained?
> 
> Thank you very much,
> 
> Shaul Wallach
> Department of Bioinformatics and Computational Chemistry
> Jerusalem College of Technology
> P.O.B. 16031
> Jerusalem 91160
> Israel
> 
> 
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-- 
David.
________________________________________________________________________
David van der Spoel, PhD, Assoc. Prof., Molecular Biophysics group,
Dept. of Cell and Molecular Biology, Uppsala University.
Husargatan 3, Box 596,  	75124 Uppsala, Sweden
phone:	46 18 471 4205		fax: 46 18 511 755
spoel at xray.bmc.uu.se	spoel at gromacs.org   http://folding.bmc.uu.se
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