Re: [gmx-users] h_bond error

2010-04-27 Thread Justin A. Lemkul 



Maurício Menegatti Rigo wrote:

Hi,

I'm trying to compute H bonds in a protein-ligand system. I got the 
following error:



Program g_hbond, VERSION 4.0.7
Source code file: gmx_hbond.c, line: 565

Fatal error:
Error in func_type Position Rest.


I use the line *g_hbond -f file.xtc -s file.tpr -n index.ndx -g 
HBOND_log -num HBOND*


/file.xtc = THis is my file with 
concatenate trajectories./



I didnt find anywhere about this error. Someone know how to fix it?



Interesting, I answered an identical post exactly one week ago:

http://lists.gromacs.org/pipermail/gmx-users/2010-April/050254.html

There is a work-around in that thread.

-Justin


Thanks!


--
Maurício Menegatti Rigo
Núcleo de Bioinformática do Laboratório de Imunogenética
Departamento de Genética
Instituto de Biociências
Universidade Federal do Rio Grande do Sul



--


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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Re: [gmx-users] h_bond error

2010-04-27 Thread Maurício Menegatti Rigo 
Thanks J.

My mistake.
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