[Jmol-users] http://www.bbc.co.uk/news/technology-35427685

2016-01-28 Thread Rzepa, Henry S
This BBC article suggests the gradual end of Java applet support, with Oracle suggesting using " plug-in free Java Web Start technology”. I have no problems with using JSmol for all the new sites I have created these last 3 years or so, but am wondering about all the legacy sites I have left

Re: [Jmol-users] http://www.bbc.co.uk/news/technology-35427685

2016-01-28 Thread Angel Herráez
Dear Henry, I agree this is a prickly issue. >From my limited experience with Java Web Start, my opinion is that it is not practical at all. You must wait for a lengthy download, then it will open, it leaves whoever knowns which and how many files in your computer, next day you use that page y

[Jmol-users] new DSSR

2016-01-28 Thread Pshemak Maslak
The new DSSR has base pairs and nucleotide indexed by numbers, For example (the 9th base-pair): auxiliaryinfo.models[1].dssr.pairs[9].bp"A-T" auxiliaryinfo.models[1].dssr.pairs[9].nt1"|1|D|A|10" auxiliaryinfo.models[1].dssr.pairs[9].nt2"|1|E|T|29" What is the proper syntax

[Jmol-users] Fwd: Re: new DSSR

2016-01-28 Thread Pshemak Maslak
Thanks Rolf! PM Forwarded per Rolf's request On 01/28/2016 07:08 PM, Pshemak Maslak wrote: > > The new DSSR has base pairs and nucleotide indexed by numbers, For > example (the 9th base-pair): > > auxiliaryinfo.models[1].dssr.pairs[9].bp"A-T" > auxiliaryinfo.models[1].dssr.pairs[9].nt1"

[Jmol-users] Electron Density Maps Made Easy

2016-01-28 Thread Eric Martz
If you ever need a non-technical explanation of electron density maps and their relationships to temperature (B value), these pages may be quite useful: http://bioinformatics.org/molvis/edm I use them in the workshops I teach on protein structure. In 2010, with Bob's help, I made these two pag

[Jmol-users] Split: Websites Using Jmol

2016-01-28 Thread Eric Martz
At http://wiki.jmol.org the page /Websites Using Jmol/ was very large (text >32K) and cumbersome to edit. I have split it into two pages of about equal length, A-L and M-Z. I also inserted blank lines between letters of the alphabet to make these pages more readable. While doing so, the en

[Jmol-users] red-blue splotches on EP isosurfaces

2016-01-28 Thread John Keller
Hi All, What causes red/blue splotches on EP isosurfaces? Is there any sure way to avoid them in jmol? John * John W. Keller, Ph.D. Professor of Chemistry Emeritus Department of Chemistry & Biochemistry Division of Research, College of Natural Science &

[Jmol-users] Minset

2016-01-28 Thread Frieda Reichsman
Hi Bob, I’m trying to get rid of scraps or shards of surface and tried the “minset” modifier in my isosurface command. Is minset applicable here? isosurface MINSET 10 id ~m40 rmsd 2.0 sign red [x00dd00] within 2.5 {ret} insideout "250u-2m-0.40.ccp4”; Thanks, Frieda //

[Jmol-users] isosurface mesh resolution question

2016-01-28 Thread Frieda Reichsman
Hi Bob, Using the following command: isosurface id ~m40 rmsd 2.0 sign red [x00dd00] within 1.5 {ret} "250u-2m-0.40.ccp4" resolution 5.0 mesh nofill; and trying to the resolution of the mesh to a finer level, I find no change in resolution from the default. I’ve tried placing “resolution 5.0” i

Re: [Jmol-users] isosurface mesh resolution question

2016-01-28 Thread Robert Hanson
Frieda, You cannot set the resolution of an isosurface that comes from a volume data file such as that using the RESOLUTION option. What you can do is use the DOWNSAMPLE option. What this does is to skip points in the grid. The RESOLUTION option is only for isosurfaces that are generated de novo b

Re: [Jmol-users] Minset

2016-01-28 Thread Robert Hanson
Yes. I just used this: isosurface minset 1000 "=1blu" mesh nofill and it worked great to remove the water density. ​ -- Site24x7 APM Insight: Get Deep Visibility into Application Performance APM + Mobile APM + RUM: Monito

Re: [Jmol-users] red-blue splotches on EP isosurfaces

2016-01-28 Thread Robert Hanson
Can you be more specific? Exact script? better: PNGJ file sent to hans...@stolaf.edu On Thu, Jan 28, 2016 at 7:20 PM, John Keller wrote: > Hi All, > > What causes red/blue splotches on EP isosurfaces? Is there any sure way to > avoid them in jmol? > > John > > > > **

Re: [Jmol-users] new DSSR

2016-01-28 Thread Robert Hanson
On Thu, Jan 28, 2016 at 1:08 PM, Pshemak Maslak wrote: > > The new DSSR has base pairs and nucleotide indexed by numbers, For > example (the 9th base-pair): > > auxiliaryinfo.models[1].dssr.pairs[9].bp"A-T" > x=_M.dssr.pairs.getProperty("SELECT nt* where bp='T-A' or bp='A-T'") select withi