Bob: it appears to me that the PubChem links are broken in test2 in today’s
new version.
On May 7, 2014, at 3:05 AM, Robert Hanson <[email protected]> wrote:
> ___JmolVersion="14.1.15"
> JmolVersion="14.1.15_2014.05.06"
>
> bug fix: CIF reader not filtering atoms by element
> bug fix: structure command may not properly remove residues from structures
> (F. Reichsman)
> bug fix: FRAME n setting frame to n - 1. (F. Reichsman)
> bug fix: unitcell {0 0 0}; in state leaves unit cell on
> bug fix: modulation of anisotropic parameters broken
> bug fix: Jana2006 reader does not accept filter "MODAVE"
> bug fix: msCIF with filter "MODAXES=X" broken
>
> JmolVersion="14.1.15_2014.05.04"
>
> new feature: reset PRINT
> -- clears the output buffer (scriptWait, scriptEcho, evaluateVar
> bug fix: color property x does not pass script check, so not allowed in web
> command box
> bug fix: echo "@{xxx}" may fail
> but fix: print @b fails for referred variable an array
> bug fix: xxx.format("%8.-3p") does not work
> bug fix: [array].format("%8.3p") does not work
> bug fix: PDB Reader skips first ANISOU record
> bug fix: SFTP not supported
> bug fix: fix for measurements not updating with modulation x.x
>
> new feature: replace()
> -- no arguments means "clean whitespace to single space and trim"
>
> new feature: replace(x, y, TRUE)
> -- all occurrences of characters of x will be replaced with y.
>
> new feature: mCIF reader
> -- Bilbao Crystallographic Server format
> -- magnetic extension to CIF reader
>
> new feature: set vectorsCentered
> -- centers vibration vector on atom
> -- vector is never animated
> -- useful for magnetic/spin properties
>
> new feature: select xyz > 1.0
> -- xyz, fxyz, fuxyz, uxyz, vxyz
> -- uses length
>
>
>
> --
> Robert M. Hanson
> Larson-Anderson Professor of Chemistry
> St. Olaf College
> Northfield, MN
> http://www.stolaf.edu/people/hansonr
>
>
> If nature does not answer first what we want,
> it is better to take what answer we get.
>
> -- Josiah Willard Gibbs, Lecture XXX, Monday, February 5, 1900
>
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Philip Bays
Emeritus Professor of Chemistry
Saint Mary's College
Notre Dame, IN 46556
[email protected]
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Is your legacy SCM system holding you back? Join Perforce May 7 to find out:
• 3 signs your SCM is hindering your productivity
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