Or try SCWRL from Dunbrack's lab... --- On Thu, 5/12/11, gauri misra <kamga...@gmail.com> wrote:
From: gauri misra <kamga...@gmail.com> Subject: Re: [ccp4bb] mutation and minimization To: CCP4BB@JISCMAIL.AC.UK Date: Thursday, May 12, 2011, 12:52 PM You can try Swiss-PDB viewer.. 2011/5/12 Thomas Holder <thomas.hol...@tuebingen.mpg.de> Hi Andreas, I would like to introduce point mutations in a structure and quickly (and dirtily) minimize the new residue. (Best rotamer dependent on local environment, or the like.) What are simple approaches that don't involve VMD/NAMD or some such overkill. PyMOL has a "Mutagenesis" wizard but you have to pick the best rotamer yourself. Cheers, Thomas -- Thomas Holder MPI for Developmental Biology Spemannstr. 35 D-72076 Tübingen