Re: [PyMOL] Automatic mutation introduction

2013-11-11 Thread White, Mark
James, What you want is something like SCWRL from the Dunbrack Lab. Minimization will not get a sc out of an incorrect rotomer, and will not repack the protein in the case of multiple mutations, SCWRL will. It can be downloaded for academic use from here: http://dunbrack.fccc.edu/SCWRL3.php/

Re: [PyMOL] sphere_scale help

2013-07-27 Thread White, Mark
Greg, You can also use the alter command to change the vdw to the value you want. This is often done with SAXS bead models so that they can then be surfaced. alter (n. ca), vdw= 3 If this is set after the show spheres command the rebuild the view rebuild Hope this helps. Best regards, Mark