[gmx-users] grompp error version 4.5.2

Adva Suez suezadva at tauex.tau.ac.il
Mon Nov 22 13:03:03 CET 2010


Hello,
I'm using your KALP in DPPC tutorial to figure out how to simulate a
molecule in a membrane in GROMACS. I'm using version 4.5.2 and from some
reason I got an error in grompp whe trying generate md_0_1.tpr.
the error is:

Program grompp_mpi, VERSION 4.5.2
Source code file: enxio.c, line: 1097

Fatal error:
Could not find frame with time 1000.000061 in
'../../membed_17_npt.edr.884814.edr'

This is weird because I only have 1000 frames in the NPT run...
Can you please help me?

Thanks,
Adva.


-- 
Adva Yeheskel
Bioinformatics Unit
Rm 001, Sherman bldg.,
 G.S.W. Faculty of Life Sciences
 Tel-Aviv University, ISRAEL 69978

 Tel: 972-3-6406840; Fax: 972-3-6405098
 E-mail: suezadva at tauex.tau.ac.il
 Web-site:
http://www.tau.ac.il/lifesci/bioinformatics.html
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