Re: [PyMOL] Surface of cavity

2006-01-21 Thread Andrea Spitaleri
Hi, you may try to use caver: http://viper.chemi.muni.cz/caver/concept.php or castp http://cast.engr.uic.edu/cast/oldindex.php regards andrea 2006/1/21, Paul Wilhelm Elsinghorst p...@uni-bonn.de: Hi, a little question regarding cavity surfaces :-) I have a set of active atoms (GOLD

Re: [PyMOL] Surface of cavity

2006-01-21 Thread Betty
Hi Paul, I have a set of active atoms (GOLD output) that surround a cavity. Now I want to dipslay the surface only for the cavity wall, not on the outside. try this: show surface for the whole protein and then hide surface for not the active residues - something like this: from pymol

RE: [PyMOL] Surface of cavity

2006-01-21 Thread Warren DeLano
Paul, PyMOL generally shows all sides of an exposed atom, but perhaps you could load both the GOLD output and the original structure. You could then only show the surface on the atoms in the original structure with corresponding atoms in the gold output as follows: load orig.pdb load gold.pdb