Hi everybody, I want to add protonation states to my protein with pdb2gmx. I now that there are the options:
-lys -arg -asp -glu -his to do this. But was is about the cystein. How can I protonate this one? Is there also an option for it which I haven't seen? Thank you , Eva -- gmx-users mailing list [email protected] http://lists.gromacs.org/mailman/listinfo/gmx-users * Only plain text messages are allowed! * 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 [email protected]. * Can't post? Read http://www.gromacs.org/Support/Mailing_Lists
