Hi all, I'm trying to get a .gro file with velocities. This command line works in 4.5.3:
$ trjconv -f file.cpt -s file.tpr -o file.gro -pbc mol -center -boxcenter zero -ur compact -ndec 6 But in 4.5.5 the output .gro file is written without the velocities, even though the -vel option is listed as "yes" in the terminal. Has this been changed on purpose? Is there a way to get the old behaviour? If you wonder why I want this, I want to continue a simulation where the coordinates of a frozen part of the system are slightly changed, so I need a file with coordinates and velocities, and then modify the coordinates. Thanks, Ignacio -- gmx-users mailing list gmx-users@gromacs.org http://lists.gromacs.org/mailman/listinfo/gmx-users Please search the archive at http://www.gromacs.org/Support/Mailing_Lists/Search before posting! Please don't post (un)subscribe requests to the list. Use the www interface or send it to gmx-users-requ...@gromacs.org. Can't post? Read http://www.gromacs.org/Support/Mailing_Lists
