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Tracker: Feature Requests

5 JMol display using cif file - ID: 1781274
Last Update: Tracker Item Submitted ( apt24 )

There is problem with the structure display for the crystallography package
search tool - the C-H bonds in ca. 50% of entries are missing.

I don't know if this due to different JUMBO versions being used when the
entries were created, but can the HTML source for the JMol display for the
crystallography search tool so that it :

i) Picks up the original cif rather than the derived CML files (i.e. that
way the unit cell can be displayed and C-H bonds - missing from the CML -
automatically added)?

ii) Can specify a RASMOL script to alter the molecule display (e.g. show
the unit cell - I don't believe this can be done from CML display)


Alan Tonge ( apt24 ) - 2007-08-24 17:25

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Interface Improvements (example)

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