[gmx-users] sridhar at dummy hydrogens and CG minimization
sridhar at www.cdfd.org.in
Wed Apr 30 06:14:01 CEST 2003
Dear Anton Feenstra,
Yes, I have used the option dummy hydrogens in pdb2gmx. I did not know it
creates constraints and So, for CG minimization this option should not be
used. But I learnt that "dummy hydrogens" option speeds up the program.
Any way, now I am removing this option and running the
program. Thanks for the help.
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