[gmx-users] Hydroxide Ion

Marc Charendoff mcharend at sbcglobal.net
Thu Jul 16 04:09:05 CEST 2009


       I am needing to include a single hydroxide ion in my simulation - is there a force field available in Gromacs that is already parameterized, or do I need to create from scratch? With regards to topology, same question, especially as PRODRG does not do mono or diatomics. Any guidance anyone could provide would be very much appreciated. I have tried searching the archives but didn't find anything.


Marc Charendoff 
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://maillist.sys.kth.se/pipermail/gromacs.org_gmx-users/attachments/20090715/6f287928/attachment.html>

More information about the gromacs.org_gmx-users mailing list