[gmx-users] tfe.itp

shahrbanoo karbalaee shahrbanoo at gmail.com
Wed Aug 20 08:06:09 CEST 2008

Dear justin
I made topology top for tfe with gromos53a5.and I solvated in spc and
40molecule tfe.I includeed tfe.itp in topology.but when I do grompp I
get  this error.(I edit the name of atoms with name in rtp file HT)
Generated 165 of the 1596 non-bonded parameter combinations
ERROR 0 [file "topol.top", line 57]:
  No default Proper Dih. types
Cleaning up temporary file gromppsYSJRG

Program grompp, VERSION 3.3.2
Source code file: toputil.c, line: 61

Fatal error:
Atomtype 'HO' not found!
my topology file is attached.

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