Results 1 - 10 for Pharmacophore

Pharmacophore Modeling in Discovery Studio
Accelrys Science Experimentally Accurate Pharmacophore Models Create optimal ligand-based pharmacophore models using two methods in DS Catalyst Hypothesis : Common feature ...
http://accelrys.com/products/datasheets/ds-pharmacophore-0308.pdf
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Pharmacophore modeling:
Pharmacophore modeling: Pharmacophore modeling based virtual screening of compounds is a ligand based approach and is useful when the 3D structure of the target is not available ...
http://www.chembiotek.com/ChemBioTek-HTML/datasheet/pharmacophore.pdf
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Pharmacophore Modeling and Database Searching
1 Pharmacophore Modeling and Database Searching Process Collect set of high-affinity ligandsfor target (from literature) Analyze conformations of each (start from least flexible ...
http://www.chem.memphis.edu/parrill/chem4315/2005/PharmacophoreModeling.pdf
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A combined ligand-based and target-based drug design approach forG ...
The power of pharmacophore-based methods for lead generation lies in their ability to suggestadiverse set of compounds potentially possessinga desired biological activity but which ...
http://www.sagewisdom.org/singhetal.pdf
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Pharmacophore Representation and Searching
PHARMACOPHORE REPRESENTATION AND SEARCHING Pharmacophore Representation and Searching In this article w e describe the design and use ofa set of Java classe s to ...
http://cheminfo.informatics.indiana.edu/~rguha/class/2009/i573/week04/cdkpcore.pdf
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Pharmacophore Analyses
Hugo Kubinyi, www.kubinyi.de 112 dopamine and 60 benzodiazepine agonists in a much larger set of 8323 structures of unknown biological activity Self-organizing Maps (SOM, Kohonen ...
http://www.kubinyi.de/dd-18.pdf
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PHARMACOPHORE-BASED VIRTUAL SCREENING WITHOUT A 3D MODEL
Tuplet Fingerprints A Tuplet fingerprint is a bitmap encoding the interfeature distances of a set of interesting pharmacophore features. Several varieties of Tuplet fingerprints ...
http://www.tripos.com/data/SYBYL/Tuplets_072505.pdf
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The substantially reduced affinities of 8- epi - 1 and tetrahydro derivative 10 suggest that the furan ring is part of the pharmacophore, as predicted. 3 However, the reduction in ...
http://www.sagewisdom.org/munroetal.pdf
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Cheminformatics and Pharmacophore Modeling, Together at Last
SciTegic Pipeline Pilot—Bridging Accord Database Explorer and Discovery Studio
http://accelrys.com/references/case-studies/cheminformatics_pharmacophore.pdf
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DEVELOP PHARMACOPHORE HYPOTHESES USING FULL CONFORMATIONAL FLEXIBILITY
For a set of ligands, GASP automatically identifies rotatable bonds and pharmacophore elements such as rings and potential hydrogen-bonding sites.
http://www.tripos.com/data/SYBYL/GASP_072505.pdf
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