Re: [PyMOL] MacPyMOL 1.4 vs 1.5 problem with color

2012-11-23 Thread Thomas Holder
Hi Adam, this seems to be not yet fully implemented with the new shader rendering. So you may turn shaders off for now: PyMOL unset use_shaders Ray tracing is not affected, so you still can generate high quality figures with correct colors: PyMOL ray Hope that helps. Cheers, Thomas H.

Re: [PyMOL] Peptide location mapping onto protein 3D structure

2012-11-23 Thread Thomas Holder
Hi Sri, if you have your structure loaded into PyMOL, you can make named selections for your peptide sequences like this: select pep1, pepseq RMFLS select pep2, pepseq KGHGK select pep3, pepseq ALSDL There are also scripts available for pattern matching, for example:

Re: [PyMOL] Controlling colors in volume object

2012-11-23 Thread Thomas Holder
Hi Per, you may check the volume_esp function here: https://github.com/speleo3/pymol-psico/blob/master/psico/electrostatics.py As Jason said in that earlier thread, the volume API is work in progress and will probably change soon. Cheers, Thomas Per Larsson wrote, On 11/21/12 19:01:

Re: [PyMOL] assigning secondary strux to artificial AAs

2012-11-23 Thread Thomas Holder
Hi Jonny, I think it should be sufficient to have the atom names along the backbone correct (CA, N, C) and to have increasing residue numbering. If you like you can send me your file and I'll have a look. Cheers, Thomas Johnny Pham wrote, On 11/15/12 09:41: Hi, I was wondering if I have

Re: [PyMOL] MacPyMOL 1.4 vs 1.5 problem with color

2012-11-23 Thread H. Adam Steinberg
Thanks Thomas, that does work. On Nov 23, 2012, at 6:31 AM, Thomas Holder wrote: Hi Adam, this seems to be not yet fully implemented with the new shader rendering. So you may turn shaders off for now: PyMOL unset use_shaders Ray tracing is not affected, so you still can generate high