Ron, the question is: who would run the Javascript? There is no JS
interpreter if you are not in a webpage
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Jaim, I think ths may be what you need, picking up the older definition of
ligand:
http://wiki.jmol.org/index.php/AtomSets
ligand:
The new definition (Jmol 12.2) includes atoms that do not belong to
protein, nucleic or solvent. That includes water, other solvent, ions and
Angel,
Thanks. For the record, Jmol rejects the file as output by Tinker (no cut ad
paste involved). Quite oddly, based on your recount of the pdb spec, simply
removing the SOURCE line does make it partially digestible; although this is
without proper identification of atom types.
As Bob
George,
Glad you managed to build a solution
Funny enough, a quick Google search gave me this 1997 very same problem
and answer:
http://www.ccl.net/chemistry/resources/messages/1997/11/27.006-dir/index.h
tml
:)
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