Search Result "protein-ligand docking."


Research Article

SAnDReS a Computational Tool for Statistical Analysis of Docking Results and Development of Scoring Functions

Journal: Combinatorial Chemistry & High Throughput Screening
Volume: 19 Issue: 10 Year: 2016 Page: 801-812
Author(s): Mariana Morrone Xavier,Gabriela Sehnem Heck,Mauricio Boff de Avila,Nayara Maria Bernhardt Levin,Val Oliveira Pintro,Nathalia Lemes Carvalho,Walter Filgueira de Azevedo

Applications of Receptor- and Ligand-based Models in Inverse Docking Experiments: Recognition of Dihydrofolate Reductase Using 7,8-Dialkyl- 1,3-Diaminopyrrolo[3,2-f]Quinazolines

Journal: Current Computer-Aided Drug Design
Volume: 12 Issue: 1 Year: 2016 Page: 15-28
Author(s): Sivakumar Prasanth Kumar,Yogesh T. Jasrai,Himanshu A. Pandya

Research Article

Enhancing Scoring Performance of Docking-Based Virtual Screening Through Machine Learning

Journal: Current Bioinformatics
Volume: 11 Issue: 4 Year: 2016 Page: 408-420
Author(s): Cândida G. Silva,Carlos J.V. Simoes,Pedro Carreiras,Rui M.M. Brito

Research Article

Design-Based Peptidomimetic Ligand Discovery to Target HIV TAR RNA Using Comparative Analysis of Different Docking Methods

Journal: Current HIV Research
Volume: 14 Issue: 6 Year: 2016 Page: 476-483
Author(s): Junjie Fu,Amy Xia,Yao Dai,Xin Qi

Review Article

GENIUS In Silico Screening Technology for HCV Drug Discovery

Journal: Current Drug Discovery Technologies
Volume: 13 Issue: 4 Year: 2016 Page: 189-198
Author(s): Vaishali M. Patil, Neeraj Masand, Satya P. Gupta

Review Article

Recent Advances in Protein-Protein Docking

Journal: Current Drug Targets
Volume: 17 Issue: 1 Year: 2016 Page: 1586-1594
Author(s): Qian Zhang, Ting Feng, Lei Xu, Huiyong Sun, Peichen Pan, Youyong Li, Dan Li, Tingjun Hou

Review Article

Molecular Docking for Identification of Potential Targets for Drug Repurposing

Journal: Current Topics in Medicinal Chemistry
Volume: 16 Issue: 3 Year: 2016 Page: 3636-3645
Author(s): Heng Luo, William Mattes, Donna L Mendrick, Huixiao Hong

Research Article

Modeling and Proposed Molecular Mechanism of Hydroxyurea Through Docking and Molecular Dynamic Simulation to Curtail the Action of Ribonucleotide Reductase

Journal: Recent Patents on Anti-Cancer Drug Discovery
Volume: 11 Issue: 4 Year: 2016 Page: 461-468
Author(s): Maryam Iman,Zeynab Khansefid,Asghar Davood

Research Article

Microwave Assisted Synthesis, Biological Characterization and Docking Studies of Pyrimidine Derivatives

Journal: Current Microwave Chemistry
Volume: 3 Issue: 3 Year: 2016 Page: 178-186
Author(s): Sanjay K. Rathwa,Manoj N. Bhoi,Mayuri A. Borad,Kinjal D. Patel,Dhanji P. Rajani,Smita D. Rajani,Hitesh D. Patel

Molecular Docking and 3D-QSAR Studies on Quinolone-based HDAC Inhibitors

Journal: Letters in Drug Design & Discovery
Volume: 13 Issue: 7 Year: 2016 Page: 577-586
Author(s): Yi Bi, Zeyun Liu, Xianxuan Liu, Xiaochen Zhang, Jing Lu

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