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[Blog]
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[News]
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Can we trust docking results? Sept 2010 IBM Systems and Technology Group releases a white paper with eHiTS and Cell
Oct 2008
EPA's ToxCastTM project will use SimBioSys' eHiTS as docking engine
Nov, 2007
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[Events]
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240th ACS
Aug 22-26, 2010 Boston, MA, USA
booth #945
see
>> more
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eHiTS LASSO:
Ligand Activity in Surface Similarity Order
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Publications
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The
activity surface point types (shown as triangles) of a Faxtor Xa
inhibitor ZK-807834 (CI-1031).
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Darryl Reid, Bashir S. Sadjad, Zsolt Zsoldos and Aniko
Simon: LASSO -
ligand activity by surface similarity order: a new tool for ligand
based virtual screening
Journal of Computer-Aided Molecular Design, http://dx.doi.org/10.1007/s10822-007-9164-5,
Published online: 18 January 2008, author's copy of the article.
doi: 10.1007/s10822-007-9164-5
Other documents:
Datasheet:
Download
eHiTS LASSO datasheet with the latest results.
Overview:
LASSO Similarity Searching
tool
LASSO Screening on the ChemSpider database
See: the blogs / announcements about this work.
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