Hi Thomas,

I think what you are looking for is fulfilled by the zoomto command.

zoomto (atomset) 0

will bring the atomset to (approximately) occupy the applet display.

I don't think this (the zero) is implemented for zoom, but I have not tried it. Also, zoomto has a timing parameter, so if you wanted the zoom to be instant, you could say

zoomto 0 (atomset) 0

-the first zero is the time in seconds that the zoom will occur over, the second zero is the "fit the atomset to the display" setting.

See the documentation for zoomto for more options.

Frieda

//////////////////////////////////////

Frieda Reichsman, PhD
Molecules in Motion
Interactive Molecular Structures
http://www.moleculesinmotion.com
413-253-2405

//////////////////////////////////////




On Aug 19, 2008, at 2:34 PM, Thomas Stout wrote:


Hi All --

I've been mucking about with "zoom" today and wondered this: is it expected behavior that the 100% level for zoom should be held constant for a loaded model? What I mean is this: when a structure is loaded, the 100% level is calculated by Jmol to be the factor at which "all atoms are completely visible on the screen through all rotations using the default vanderWaals rendering percentage." If I then issue "zoom 200", the display is zoomed in by 200 percent -- expected behavior. If, however, I issue: "zoom (atom expression) 100" (for example, "zoom (*:B) 100"), would it not be reasonable to expect the display to be altered such that the stated atom expression is now scaled to (approximately) fit the Jmol display?

I'd like to use this to automatically transition to selected portions of PDB files (such as ligands or amino acid ranges of interest) and have the proper display zoom auto-calculated.

Is there another way to do this? Can I calculate on the fly a boundbox for the current selection and set the zoom level to fill the display with this new boundbox?

Cheers,
Tom
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