Hi again, I forgot to mention that the functional groups that I will consider have overall no net charge. I gave the hydroxyl group as a prototypical example in my last post, but this is a bad example because hydroxyl groups are typically not neutral. The groups that I will consider will be.
Thanks, Andrew DeYoung Carnegie Mellon University -- gmx-users mailing list gmx-users@gromacs.org http://lists.gromacs.org/mailman/listinfo/gmx-users * Please search the archive at http://www.gromacs.org/Support/Mailing_Lists/Search before posting! * Please don't post (un)subscribe requests to the list. Use the www interface or send it to gmx-users-requ...@gromacs.org. * Can't post? Read http://www.gromacs.org/Support/Mailing_Lists
