[gmx-developers] short range energies
David van der Spoel
spoel at xray.bmc.uu.se
Wed Mar 20 21:26:24 CET 2002
On Wed, 20 Mar 2002, Mehmet Suezen wrote:
>Dear Gromacs Developers,
>Where short range energies are written in to a file and calculated?
Calculated in force (or fnbf to be more precise) and written in mdebin.
Or do I misunderstand you?
Groeten, David.
________________________________________________________________________
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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