[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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