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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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| 243rd ACS
Mar 25-29, 2012
San Diego, CA
see >> more
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Validation: test-set-small,
image: palytoxin300
CLiDE takes the black and white bitmap image
and converts it into various file formats, including: ChemDraw, MOL files.
Input |
Output |
Input: Molecule in Windows bitmap file
format
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Output 1: Molecule in MOL file format (ASCII)
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Output 2: Molecule in ChemDraw file format
(binary)
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Output 3: Molecule in CLiDE's own ASCII
file format
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ScreenShot of the input image: |
ScreenShot of the output, which was recognised
with very high accuracy: |
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