[gmx-users] grompp

Michal Walczak meehow.w at gmail.com
Mon Oct 23 22:52:03 CEST 2006

Hi there!

I wanted to convert *. mdp file to get .tpr file and have changes in
*.top so I put down such a command: grompp -f fullmd_sol.mdp -c
minimized_water.gro -p aki.top -o fullmd.tpr . One fatal error occured
saying that there was error ie\\with proccessing input file. It worked
fine for protein, but now for 3 aa peptide it got stuck. Which input
was incorrect? What should I do now ?

Best wishes,

Michal Walczak

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