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Chemistry Explained by Topology: An Alternative Approach

Journal: Combinatorial Chemistry & High Throughput Screening
Volume: 14 Issue: 4 Year: 2011 Page: 279-283
Author(s):

Describing the Molecular Mechanism of Organic Reactions by Using Topological Analysis of Electronic Localization Function

Journal: Current Organic Chemistry
Volume: 15 Issue: 2 Year: 2011 Page: 3566-3575
Author(s): J. Andres, S. Berski, L. R. Domingo, V. Polo, B. Silvi

Use of Physicochemical and Topological Parameters in Estimating Anti-Cancer Activity of Benzothiazole Derivatives

Journal: Letters in Drug Design & Discovery
Volume: 8 Issue: 9 Year: 2011 Page: 850-856
Author(s): Deepali Gupta, Basheerulla Shaik, Jyoti Singh, Neelu Singh, Vijay K. Agrawal

On Molecular Graph Comparison

Journal: Current Computer-Aided Drug Design
Volume: 7 Issue: 2 Year: 2011 Page: 83-89
Author(s): Jenny A. Melo, Edgar Daza

Quantitative Structure-Activity Relationships for Anticancer Activity of 2- Phenylindoles Using Mathematical Molecular Descriptors

Journal: Current Computer-Aided Drug Design
Volume: 7 Issue: 2 Year: 2011 Page: 98-108
Author(s): Subhash C. Basak, Qianhong Zhu, Denise Mills

Search of QSAR Models for Predicting the Antiprotozoal Activity and Cytotoxicity In Vitro of a Group of Pentamidine Analogous Compounds

Journal: Letters in Drug Design & Discovery
Volume: 8 Issue: 2 Year: 2011 Page: 172-180
Author(s): Ramon Garcia-Domenech, Isabel Denise Manhenje, Yamileth Monje, Adassa Lopez-Gonzalez, Rafael Marco, Catalina Tacho, Jorge Galvez

Investigation of Structure-Activity Relationship Between Chemical Structure and CCR5 Anti HIV-1 Activity in a Class of 1-[N-(Methyl)-N- (Phenylsulfonyl)Amino]-2-(Phenyl)-4-[4-(Substituted)Piperidin-1-yl]Butane Derivatives: The Electronic-Topological Approach

Journal: Current HIV Research
Volume: 9 Issue: 5 Year: 2011 Page: 300-312
Author(s): Murat Saracoglu, Sedat Giray Kandemirli, Murat Alper Basaran, Hakan Sayiner, Fatma Kandemirli

Chemotopology: Beyond Neighbourhoods

Journal: Current Computer-Aided Drug Design
Volume: 7 Issue: 2 Year: 2011 Page: 90-97
Author(s): Guillermo Restrepo, Heber Mesa

Multiscale Molecular Dynamics of Protein Aggregation

Journal: Current Protein & Peptide Science
Volume: 12 Issue: 3 Year: 2011 Page: 221-234
Author(s): Cesar L. Avila, Nils J. D. Drechsel, Raul Alcantara, Jordi Villa-Freixa

Definition of Markov-Harary Invariants and Review of Classic Topological Indices and Databases in Biology, Parasitology, Technology,and Social-Legal Networks

Journal: Current Bioinformatics
Volume: 6 Issue: 1 Year: 2011 Page: 94-121
Author(s):

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