[gmx-developers] TIP4P naming
Roland Schulz
roland at utk.edu
Fri Jun 18 08:43:59 CEST 2010
Hi,
is there any reason not to rename MW to HW3 in tip4p.gro? Renaming this
would make it match to the aminoacids.rtp files. And thus pdb2gmx would
accept the naming from genbox.
Roland
--
ORNL/UT Center for Molecular Biophysics cmb.ornl.gov
865-241-1537, ORNL PO BOX 2008 MS6309
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://maillist.sys.kth.se/pipermail/gromacs.org_gmx-developers/attachments/20100618/d969392b/attachment.html>
More information about the gromacs.org_gmx-developers
mailing list