[gmx-users] PS. freeze group speed up

Sung-Joo Lee sungjoo at stanford.edu
Wed Jul 14 01:11:05 CEST 2004

Previous message: [gmx-users] freezing atoms does not speed up calculation
Next message: [gmx-users] pdb
Messages sorted by: [ date ] [ thread ] [ subject ] [ author ]

HI,
I just realized I didn't specify
energy_grps and energy_grp_excl so the energy calculation within the 
freeze group is excluded.

Sungjoo

Previous message: [gmx-users] freezing atoms does not speed up calculation
Next message: [gmx-users] pdb
Messages sorted by: [ date ] [ thread ] [ subject ] [ author ]

More information about the gromacs.org_gmx-users mailing list