[gmx-users] about H-Bonds g_hbond

[Justin A. Lemkul]

Erik Marklund wrote:
> Hi,
> 
> Please submit a bugzilla, assign it to me, and I'll try to fix it along 
> with heaps of other things.
> 

This bug has been outstanding for some time already:

http://bugzilla.gromacs.org/show_bug.cgi?id=334

-Justin

> Erik Marklund
> 
> Justin A. Lemkul skrev:
>>
>>
>> babu gokul wrote:
>>> Hi all
>>> I am getting an error in g_hbond such as
>>>  
>>>  " Program g_hbond_d, VERSION 4.0.7
>>> Source code file: gmx_hbond.c, line: 565
>>> Fatal error:
>>> Error in func_type Position Rest."
>>>  
>>>  Could anyone tell me how to solve this problem.
>>> thanks in advance
>>>  
>>
>> If you have position restraints defined, you can't run g_hbond for 
>> some reason.  The work-around is to re-generate a .tpr file that does 
>> not use position restraints and do the analysis.
>>
>> -Justin
>>
>>> E R Azhagiya singam
>>>
>>> Send free SMS to your Friends on Mobile from your Yahoo! Messenger. 
>>> Download Now! http://messenger.yahoo.com/download.php
>>>
>>
> 
> 

-- 
========================================

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

========================================