VMD-L Mailing List

From: Dominique Vlieghe (Dominique.Vlieghe_at_dmbr.UGent.be)
Date: Mon Jun 23 2003 - 10:34:45 CDT

Hi all,

Is it possible to do simple energy calculations within VMD (without
prior energy minimisations and/or dynamics). Furthermore, is it possible
to calculate energies between (atom) selections?

Regards,

Dominique 

-- 
------------------------------
Dominique Vlieghe, Ph.D.,
Bioinformatics Core,
Dept. Molecular Biomedical Research & V.I.B.,
Ghent University,
K.L. Ledeganckstraat 35,
B-9000 Ghent,
Belgium
Tel.: 32-9-2648749
Fax.: 32-9-2645348
email:dominique.vlieghe_at_dmb.rug.ac.be
www:http://www.dmb.rug.ac.be/
------------------------------