[gmx-users] problem with trjconv
sudheer babu
sudheer.pbm07 at gmail.com
Mon Mar 3 12:52:13 CET 2008
Hi all,
I am trying to use *trjconv command for -pbc but POPC molecules are breaking
when visualize in VMD. The commands used are
grompp -f pr.mdp -c em_out.gro -p .top -n index.ndx -o out.tpr
trjconv -f em_out.gro -s out.tpr -o trj_out.gro -pbc inbox or cluster or
whole
Thi trj_out.gro contain broken POPC molecules
Pls suggest me what options I have to use for -pbc? or any addition option I
have to use?
Thanks in advance.......
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