[gmx-users] Amber6.0 -> GROMACS3.1 ?
David van der Spoel
spoel at xray.bmc.uu.se
Fri May 3 14:39:55 CEST 2002
On Fri, 3 May 2002, Wolfgang Zocher wrote:
>I have an article which describes simulations done with Amber6.0.
>Although the simulations are not described in detail I would like to
>redo it with GROMACS. My question is: has anybody out there some
>references to comparisons between these programs?
Apart from performance benchmarks there are none that I know off. Do you
mean force field comparisons?
Dr. David van der Spoel, Biomedical center, Dept. of Biochemistry
Husargatan 3, Box 576, 75123 Uppsala, Sweden
phone: 46 18 471 4205 fax: 46 18 511 755
spoel at xray.bmc.uu.se spoel at gromacs.org http://zorn.bmc.uu.se/~spoel
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