Publications by authors named "Ansgar Schuffenhauer"

38Publications

Latent hit series hidden in high-throughput screening data.

J Med Chem 2012 Feb 23;55(3):1161-70. Epub 2012 Jan 23.

Novartis Institutes for BioMedical Research, Forum 1, Novartis Campus, CH-4056 Basel, Switzerland.

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February 2012

Rule-Based Classification of Chemical Structures by Scaffold.

Mol Inform 2011 Aug 16;30(8):646-64. Epub 2011 Aug 16.

Novartis Institutes for BioMedical Research, CPC/LFP, WSJ-88.11.11, Postfach, Basel, Switzerland, CH-4002; phone:+41 61 32 45385.

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August 2011

Mining for bioactive scaffolds with scaffold networks: improved compound set enrichment from primary screening data.

J Chem Inf Model 2011 Jul 15;51(7):1528-38. Epub 2011 Jun 15.

Novartis Institutes for BioMedical Research, Forum 1, Novartis Campus, CH-4056 Basel, Switzerland.

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July 2011

Recent trends and observations in the design of high-quality screening collections.

Future Med Chem 2011 Apr;3(6):751-66

Novartis Institutes for BioMedical Research, Center for Proteomic Chemistry, Forum 1, Novartis Campus, CH-4056 Basel, Switzerland.

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April 2011

MultiMCS: a fast algorithm for the maximum common substructure problem on multiple molecules.

J Chem Inf Model 2011 Apr 29;51(4):788-806. Epub 2011 Mar 29.

Strand Life Sciences, Fifth Floor, Kirloskar Business Park, Bellary Road, Hebbal, Bangalore 560024, India.

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April 2011

Compound set enrichment: a novel approach to analysis of primary HTS data.

J Chem Inf Model 2010 Dec 12;50(12):2067-78. Epub 2010 Nov 12.

Novartis Institutes for BioMedical Research, Novartis Pharma AG, Forum 1, Novartis Campus, CH-4056 Basel, Switzerland, and 250 Massachusetts Avenue, Cambridge, Massachusetts 02139, USA.

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December 2010

The scaffold tree: an efficient navigation in the scaffold universe.

Methods Mol Biol 2011 ;672:245-60

Novartis Institutes for BioMedical Research, Basel, Switzerland.

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February 2011

Estimation of synthetic accessibility score of drug-like molecules based on molecular complexity and fragment contributions.

J Cheminform 2009 Jun 10;1(1). Epub 2009 Jun 10.

Novartis Institutes for BioMedical Research, Novartis Campus, CH-4002 Basel, Switzerland.

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June 2009

Cheminformatics analysis of natural products: lessons from nature inspiring the design of new drugs.

Prog Drug Res 2008 ;66:217, 219-35

Novartis Institutes for BioMedical Research, 4002 Basel, Switzerland.

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May 2008