December 2008 - Chimera-users - RBVI Mailing Lists

building a alpha helix
by Anindito Sen 04 Dec '08

04 Dec '08

Dear All I was wondering if there is any tool by which can generate an alpha helix, as an extension of a truncated crystal structure docked in the density map. The possibility of the truncated portion of the protein behaving as an alpha helix has been predicted by different groups. The density map shows some empty regions (after the crystal structure has been docked) just good enough for an alpha helix to fit in. Best Andy Dr. Anindito Sen (Ph.D) Research Associate , Dept. of Biochemistry and Molecular Genetics University of Virginia Box 800733 Charlottesville, VA 22908

2 1

Transparency of ribbons
by lvyuan zhang 04 Dec '08

04 Dec '08

Hi all, I'm a new user and my question maybe a little weird to you guys. I want to make some parts of my protein, let's say "A", partially transparent, so when compared to other parts of the protein, let's say "B", these "A" parts are hardly visible (the background is white). So I set the alpha value of "A" to less than 1, such as 0.1. then I save the image with POV-ray. The resulted "A" is too dark, and it is still quite "visible". Is there any way to make partially transparent ribbons lighter, instead of darker than non-transparent ones? I would really appreciate it if any one can help resolve this problem. Thans! Cheers! Luyuan Zhang

2 2

Software(Drug Design)
by Tarit Mitra 04 Dec '08

04 Dec '08

28, Ashfield Green Yateley Hants GU46 6AL UK Dear Sir, I am a retired scientist, and working on an honorary basis for the University of London. I work from home and go to the University in regular interval. I would very much like to use your software for drug design. I was wondering whether you would grant me a free academic licence to the software. I shall only use the software for academic purpose and not for any financial reason whatsoever. I have both Linux(Ubantu) and Windows XP. My computer has 40GB hard disk with 756MB RAM I shall be grateful if you will kindly consider my case favourably. Yours faithfully T. K. Mitra, B.Sc(London), Ph.D(London)

2 1

opaque background
by Mueller, Juergen-Joachim 01 Dec '08

01 Dec '08

Dear all, is there a possibility to make the background invisible to be able to overlay a structure over anything? Thanks, Juergen

2 1

Chimera rotational matrix
by Bui Khanh Huy 01 Dec '08

01 Dec '08

Hi, I notice that Chimera has slightly different in calculation of transform when I tried to rotate my EM density (200x200x200 mrc file) using Chimera. The origin of the density reported by Volume Viewer is 0,0,0 First, I print out the homologous transform matrix using: >>> om = chimera.openModels >>> mlist = om.list() >>> m = mlist[0] >>> print m.openState.xform The transformation is: 1 0 0 0 0 1 0 0 0 0 1 0 If I rotate the model using command: roll z -30 1 Then print out the transform matrix again: 0.866025 0.5 0 -36.8852 -0.5 0.866025 0 61.2937 0 0 0 1 That would be weird because I didn't do any translation. So what is really happening in Chimera when I rotate the model? Best, Huy

4 3

How to generate submodels in a mol2 file in Chimera?
by CHIU,YEUNG 01 Dec '08

01 Dec '08

Dear friends, Hello! I'm wondering how many models and submodels in all can Chimera save into one single mol2 file? Right now I can have models only 0-9 into one single mol2 file. I think I'm going to use submodels, but how can I generate them? For instance, if I have a brunch of pdb files which contain one molecule each, I'd like to combine them into one mol2 file, which has a submodel corresponding to each molecule. (If this statement of the problem is not clear enough, please let me know). Thank you for your help and sorry to bother the others. Best wishes. Sincerely yours CHIU,YEUNG

3 2

Chimera-users December 2008