I'm looking for the equivalent to "getProperty ligandInfo" that will return the
complete list of names in HET or HETAM
definitely:
boolean isHetero = line.startsWith("HETATM");
On Fri, Jan 24, 2014 at 6:16 PM, Robert Hanson
<hans...@stolaf.edu<mailto:hans...@stolaf.edu>> wrote:
select hetero
?
On Wed, Jan 22, 2014 at 12:16 PM, Jaime Prilusky
<jaime.prilu...@weizmann.ac.il<mailto:jaime.prilu...@weizmann.ac.il>> wrote:
Thank you Angel for the explanation. Still looking for a solution.
Jaim
On Jan 22, 2014, at 5:00 PM, Angel Herráez
<angel.herr...@uah.es<mailto:angel.herr...@uah.es>> wrote:
> I'm guessing, but ATP may be recognized as "nucleic" by Jmol
> algorithm and hence excluded from the ligand set, which is not
> protein, not nucleic, not solvent if I remember correctly
>
> Sorry, ligand used to be hetero and not solvent, but the problem may
> be along those lines.
>
>
>
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--
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
--
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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