[gmx-users] multiple "define" statements...

[Ken Rotondi]

in the .mdp file. Is this allowable? E.g.

define	= DFELXIBLE
define	= DPOSRE

if I wanted to do a minimization of SPC water while restraining the 
protein atoms to their .pdb coordinates.

Thanks,

Ken


K.S. Rotondi Ph.D.
Research Fellow
The Gierasch Laboratory
Department of Biochemistry and Molecular Biology
University of Massachusetts-Amherst
Phone: 413-545-1250
Fax;      413-545-3291