[gmx-users] topology database

Dhananjay dhananjay.c.joshi at gmail.com
Tue Apr 4 13:17:22 CEST 2006


Hello all,

while pdb2gmx on my pdb I got following error

-------------------------------------------------------
Program pdb2gmx, VERSION 3.3
Source code file: resall.c, line: 438

Fatal error:
Residue 'MSE' not found in residue topology database



Will it be possible to add MSE in topology database of Gromacs?
If yes then how to add it ?

 if anyone have any other solution please tell me....


-- Dhananjay
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