Search Result "molecular descriptors and metabolism."


Understanding the Molecular Properties and Metabolism of Top Prescribed Drugs

Journal: Current Topics in Medicinal Chemistry
Volume: 13 Issue: 11 Year: 2013 Page: 1290-1307
Author(s): Haizhen A. Zhong,Victoria Mashinson,Theodor A. Woolman,Mengyi Zha

Mathematical Descriptors for the Prediction of Property, Bioactivity, and Toxicity of Chemicals from their Structure: A Chemical-Cum-Biochemical Approach

Journal: Current Computer-Aided Drug Design
Volume: 9 Issue: 4 Year: 2013 Page: 449-462
Author(s): Subhash C. Basak

Evolutionary Computation and QSAR Research

Journal: Current Computer-Aided Drug Design
Volume: 9 Issue: 2 Year: 2013 Page: 206-225
Author(s): Vanessa Aguiar-Pulido,Marcos Gestal,Maykel Cruz-Monteagudo,Juan R. Rabunal,Julian Dorado,Cristian R. Munteanu

In Silico Prediction of Cytochrome P450-Mediated Site of Metabolism (SOM)

Journal: Protein & Peptide Letters
Volume: 20 Issue: 3 Year: 2013 Page: 279-289
Author(s): Xian Liu,Qiancheng Shen,Jing Li,Shanshan Li,Cheng Luo,Weiliang Zhu,Xiaomin Luo,Mingyue Zheng,Hualiang Jiang

Small Molecules' Multi-Metabolic Pathways Prediction Using Physico- Chemical Features and Multi-Task Learning Method.

Journal: Current Bioinformatics
Volume: 8 Issue: 5 Year: 2013 Page: 564-568
Author(s): Bing Niu,Lei Gu,Chunrong Peng,Juan Ding,Xiaochen Yuan,Wencong Lu

Anti-cancer Drug Development: Computational Strategies to Identify and Target Proteins Involved in Cancer Metabolism

Journal: Current Pharmaceutical Design
Volume: 19 Issue: 4 Year: 2013 Page: 532-577
Author(s): Lora Mak, Sonia Liggi, Lu Tan, Kanthida Kusonmano, Judith M. Rollinger, Alexios Koutsoukas, Robert C. Glen, Johannes Kirchmair

The Impact of Computer Science in Molecular Medicine: Enabling High- Throughput Research

Journal: Current Topics in Medicinal Chemistry
Volume: 13 Issue: 5 Year: 2013 Page: 526-575
Author(s): Diana de la Iglesia, Miguel Garcia-Remesal, Guillermo de la Calle, Casimir Kulikowski, Ferran Sanz, Victor Maojo

3D-QSAR Methodologies and Molecular Modeling in Bioinformatics for the Search of Novel Anti-HIV Therapies: Rational Design of Entry Inhibitors

Journal: Current Bioinformatics
Volume: 8 Issue: 4 Year: 2013 Page: 452-464
Author(s): Alejandro Speck-Planche, Valeria V. Kleandrova, Marcus T. Scotti, M. N.D.S. Cordeiro

Using Cheminformatics for the Identification of Biological Functions of Small Molecules in Metabolic Pathway

Journal: Current Topics in Medicinal Chemistry
Volume: 13 Issue: 1 Year: 2013 Page: 1201-1210
Author(s): Bing Niu, Wencong Lu

Cluster Based SVR-QSAR Modelling for HTS Records: An Implementation for Anticancer Leads Against Human Breast Cancer

Journal: Combinatorial Chemistry & High Throughput Screening
Volume: 16 Issue: 7 Year: 2013 Page: 511-521
Author(s): Om Prakash,Feroz Khan

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