[gmx-users] Error: No such moleculetype Protein

Anirban Ghosh reach.anirban.ghosh at gmail.com
Thu Feb 10 12:01:58 CET 2011


I am trying to convert a CG system containing multiple copies of a protein +
lipid + water + ions to an all-atom system using the special gromacs_reverse
version command g_fg2cg. However I am getting the error:

calling cpp...
processing topology...
Generated 4 of the 780 non-bonded parameter combinations
Cleaning up temporary file grompp9YJMaA
Program g_fg2cg, VERSION 3.3.1
Source code file: ../kernel/toppush.c, line: 1293

Fatal error:
No such moleculetype Protein

I have checked all the include statements and .itp files, but cannot fix the
issue. Is seems to be very trivial but still exists.
Any suggestion is welcome.


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