VMD-L Mailing List

From: Martin, Erik W (Erik.Martin_at_stjude.org)
Date: Thu Apr 17 2014 - 16:32:13 CDT

Hi, I am interested in phosphorylating a number of residues on an (huge) ensemble of pdbs. Its fairly simple, I just need to load then mutate the residues to the phosphorylated analog then move on to the next structure. Before I start writing a script for this sort of thing, I was wondering if anyone had done this before… also, if there is a better way to do it feel free to educate me.

Thanks
Erik

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