[PyMOL] Using pyvol in pymall

2020-11-17 Thread ALBAYATI SAMAH HASHIM KHALEEL / UPM
Hi any one have an idea how to use pyvol plugin pymall to measure the binding site volume and how to display different binding site shape.Thanks Samah Hashim ___ PyMOL-users mailing list Archives: http://www.mail-archive.com/pymol-users@lists.sourceforge.

Re: [PyMOL] VdW radii

2020-11-17 Thread Thomas Holder
Hi Timofey, There is currently no way to automatically substitute the radii. But you can bind a keyboard shortcut to do the substitution, maybe that's convenient enough? Put this in your pymolrc to bind the F1 key: python @cmd.set_key("F1") def update_ionic_radii(selection="all"): cmd.alte

Re: [PyMOL] Importing Pymol as library

2020-11-17 Thread Thomas Holder
Hi Yannis, Here is a way to suppress it (not very elegant, sorry): from pymol import cmd if cmd._COb is None: import pymol2 import pymol.invocation pymol.invocation.parse_args(['pymol', '-q']) # optional, for quiet flag pymol2.SingletonPyMOL().start() Cheers, Thomas > On Nov