[gmx-users] POPC simulation

Steffen Wolf swolf at bph.rub.de
Tue May 23 09:30:35 CEST 2006


Hi Arindam,
you've simply got to switch two lines in the *.top file: lipid.itp has 
to be called by the topology before popc.itp, as it contains the 
information on atomtypes for GROMACS. So:

#include "lipid.itp"
#include "popc.itp"

should work just fine.
Greetings
Steffen

-- 
Dipl.-Chem. Steffen Wolf
Department of Biophysics
University of Bochum
ND 04/67
44780 Bochum
Germany
Tel: +49 (0)234 32 28363
Fax: +49 (0)234 32 14626
E-Mail: swolf at bph.rub.de
Web: http://www.bph.rub.de 




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