[gmx-users] Molecule redefined
Justin A. Lemkul
jalemkul at vt.edu
Fri Dec 10 14:51:22 CET 2010
Tanos Celmar Costa Franca wrote:
>
> 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
>
You have two (or more) instances of the same [moleculetype]. Either you've
#included an .itp file multiple times, or you've otherwise assigned repetitive
names.
-Justin
> 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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--
========================================
Justin A. Lemkul
Ph.D. Candidate
ICTAS Doctoral Scholar
MILES-IGERT Trainee
Department of Biochemistry
Virginia Tech
Blacksburg, VA
jalemkul[at]vt.edu | (540) 231-9080
http://www.bevanlab.biochem.vt.edu/Pages/Personal/justin
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