[gmx-users] Problems with Ion
Fábio Filippi Matioli
fabiofima at hotmail.com
Wed Nov 19 22:30:11 CET 2014
Hello, I have a new problem today with gromacs.
After the mdrun,
the gromcas generate a after.gro, that its the protein after the MD. But
on this file the CA ions its in different positions when compared with
the movie generated on VMD using the after and the .trr, fixed the jump
box using the trjconv.
I would like to generate a pdb with the last frame of the MD's movie
Can you help me please?
Fábio Filippi MatioliMestrando
Departamento de Física e BiofísicaInstituto de BiociênciasUNESP - Campus de BotucatuCel (19) 9.9291.6738
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