Hello, 1] I wanted to simulate beta-alanine amino acid. Since i am using charmm 36 FF for simulation of other molecules too, so prefer using the same Forcefield. But i tried searching in the .rtp file, but only alanine [ALA] amino-acid is there...but not beta-alanine. So i am not able to find it in charmm 36 FF ... So can anybody help/suggest on how to solve this issue..
2] How can i find the required molecule in the .rtp file..?? since its full name is not written in the file.for eg., what is [ 11BPO ]..?? which molecule does it represent..?? etc... Thank you... -- With Best Regards, DILIP.H.N Ph.D Student <https://mailtrack.io/> Sent with Mailtrack <https://chrome.google.com/webstore/detail/mailtrack-for-gmail-inbox/ndnaehgpjlnokgebbaldlmgkapkpjkkb?utm_source=gmail&utm_medium=signature&utm_campaign=signaturevirality> <#> -- Gromacs Users mailing list * Please search the archive at http://www.gromacs.org/Support/Mailing_Lists/GMX-Users_List before posting! * Can't post? Read http://www.gromacs.org/Support/Mailing_Lists * For (un)subscribe requests visit https://maillist.sys.kth.se/mailman/listinfo/gromacs.org_gmx-users or send a mail to gmx-users-requ...@gromacs.org.
