[gmx-users] some problems by freshman?

David spoel at xray.bmc.uu.se
Thu Aug 15 18:45:29 CEST 2002

On Thu, 2002-08-15 at 17:15, zpxu wrote:

You have to be a bit more specific. How do you treat the ends of the
tube? Or is it supposed to be infinite?

What happens in the minimization? Did you check energy components?

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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