[gmx-users] g_hbond error

krishnakumar krishhere at gmail.com
Thu Jun 4 23:43:28 CEST 2009


Hi,

Has any one encountered this error while using g_hbond?

*********************************************************************

Select a group: 12
Selected 12: 'SOL'
Select a group: 12
Selected 12: 'SOL'
Calculating hydrogen bonds in SOL (20949 atoms)

-------------------------------------------------------
Program g_hbond, VERSION 4.0.4
Source code file: gmx_hbond.c, line: 565

Fatal error:
Error in func_type Position Rest.
-------------------------------------------------------
************************************************************************


I get this error only when using trajectory with positional restraint during
MD.
Is there any fix for this bug?

Thanks
Krishna
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://maillist.sys.kth.se/pipermail/gromacs.org_gmx-users/attachments/20090604/d092b778/attachment.html>


More information about the gromacs.org_gmx-users mailing list