[gmx-users] Molecule redefined

Tanos Celmar Costa Franca tanos at ime.eb.br
Fri Dec 10 14:39:36 CET 2010


Dear gmx users,
Does someone knows what does it means the error mesage below and how  
do I fix it ?

Program grompp, VERSION 4.0.3
Source code file: ../../../../src/kernel/toppush.c, line: 1006

Fatal error:
moleculetype NDP is redefined

I thank i advance for any help.
Tanos Celmar Costa Franca - D.Sc
Coordenador do Programa de Pos-graduacão em Química
Secão de Engenharia Química - SE/5
Instituto Militar de Engenharia - IME
Rio de Janeiro - RJ
Brasil





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