[gmx-users] Atomtype SDMSO not found - GROMACS

Manasa Surakala manasanani2011 at gmail.com
Tue Nov 15 11:22:04 CET 2016

I am new to GROMACS, running protein-ligand simulation.

The error is as follows:

*Fatal error:*
*Atomtype SDMSO not found. *

after the command: gmx grompp -f em.mdp -c solv_13948302.gro -p topol.top
-o ions_13948302.tpr

Can you please help me to overcome this error?

Thanks in advance,


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