Re: [PyMOL] Viewing cavities?

2005-11-02 Thread Eric Zollars
Marcus, Here is one way (courtesy Kyle Lassila): Check out VOIDOO: http://xray.bmc.uu.se/usf/voidoo.html Then: Use VOIDOO to make a map of the cavity. That gives a map in one of the electron density formats, .ezd. Then use MAPMAN (also found as Uppsala Software Factory) to convert to

[PyMOL] wild card

2004-02-18 Thread Eric Zollars
Anyone who works with nucleic acids will certainly prefer the current situation. From the PDB format guidelines: * The asterisk (*) is used in place of the prime character (') for naming atoms of the sugar group. The prime was avoided historically because of non-uniformity of its external

[PyMOL] save molecule format

2004-02-13 Thread Eric Zollars
9.752 1.00 10.35 C ATOM 93 C SER A 13 1.623 10.233 19.278 1.00 9.48 C ATOM 94 O SER A 13 1.775 10.681 18.144 1.00 10.31 O As far as I can tell it only happens with those sidechains with multiple conformations. Anyone else have this problem? Is there a quick fix? Pymol 0.93 on Fedora Core 1. Th