Search Result "Compound similarity"


Molecular Similarity and Property Similarity

Journal: Current Topics in Medicinal Chemistry
Volume: 4 Issue: 6 Year: 2004 Page: 589-600
Author(s): Frederique Barbosa, Dragos Horvath

3D Similarity Search for Lead Compound Identification

Ebook: In Silico Lead Discovery
Volume: 1 Year: 2011
Author(s): Frederic Guyon,Pierre Tuffery
Doi: 10.2174/978160805142711101010047

Recent Studies on Similarity Measures and its Applications to Chemoinformatics and Drug Design

Ebook: Recent Trends on QSAR in the Pharmaceutical Perceptions
Volume: 1 Year: 2012
Author(s): Alan Talevi,Eduardo A. Castro,Luis E. Bruno-Blanch
Doi: 10.2174/978160805379711201010272

Advanced Fingerprint Methods for Similarity Searching: Balancing Molecular Complexity Effects

Journal: Combinatorial Chemistry & High Throughput Screening
Volume: 13 Issue: 3 Year: 2010 Page: 220-228
Author(s): Yuan Wang, Jurgen Bajorath

Using Compound Similarity and Functional Domain Composition for Prediction of Drug-Target Interaction Networks

Journal: Medicinal Chemistry
Volume: 6 Issue: 6 Year: 2010 Page: 388-395
Author(s): Lei Chen, Zhi-Song He, Tao Huang, Yu-Dong Cai

Similarity in Chemical Reaction Networks: Categories, Concepts and Closures

Ebook: Advances in Mathematical Chemistry and Applications
Volume: 2 Year: 2015
Author(s): Andrés Bernal,Eugenio Llanos,Wilmer Leal,Guillermo Restrepo
Doi: 10.2174/9781681080529115020006

Structural Similarity and Descriptor Spaces for Clustering and Development of QSAR Models§

Journal: Current Computer-Aided Drug Design
Volume: 9 Issue: 2 Year: 2013 Page: 254-271
Author(s): Irene Luque Ruiz,Gonzalo Cerruela Garcia,Miguel Angel Gomez-Nieto

Correlating Low-Similarity Peptide Sequences and Allergenic Epitopes

Journal: Current Pharmaceutical Design
Volume: 14 Issue: 3 Year: 2008 Page: 289-295
Author(s): D. Kanduc

Review Article

Discriminating Drug-Like Compounds by Partition Trees with Quantum Similarity Indices and Graph Invariants

Journal: Current Pharmaceutical Design
Volume: 22 Issue: 34 Year: 2016 Page: 5179-5195
Author(s): Jesus V. de Julián-Ortiz,Rafael Gozalbes,Emili Besalú

Computational Techniques for Diversity Analysis and Compound Classification

Journal: Mini-Reviews in Medicinal Chemistry
Volume: 4 Issue: 1 Year: 2004 Page: 1029-1039
Author(s): D. B. Kitchen, F. L. Stahura, J. Bajorath

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