[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