Search Result "Pharmacophore mapping"


Research Article

CETP Inhibitory Activity of Chlorobenzyl Benzamides: QPLD Docking, Pharmacophore Mapping and Synthesis

Journal: Letters in Drug Design & Discovery
Volume: 14 Issue: 1 Year: 2017 Page: 1391-1400
Author(s): Reema Abu Khalaf, Hamada Abd El-Aziz, Dima Sabbah, Ghadeer Albadawi, Ghassan Abu Sheikha

Research Article

Development of Novel Selective Pharmacophore for Tankyrase Inhibitors

Journal: Letters in Drug Design & Discovery
Volume: 14 Issue: 10 Year: 2017 Page: 1164-1175
Author(s): Xin Qiao,Ting Ran,Yan-Min Zhang,Jing Pan,Ling-Feng Yin,Wei-Neng Zhou,Lu Zhu,Jun-Nan Zhao,Hai-Chun Liu,Shuai Lu,Tao Lu,Ya-Dong Chen,Yu-Lei Jiang

Review Article

Development of a Predictive Pharmacophore Model and a 3D-QSAR Study for an in silico Screening of New Potent Bcr-Abl Kinase Inhibitors

Journal: Mini-Reviews in Medicinal Chemistry
Volume: 17 Issue: 3 Year: 2017 Page: 188-204
Author(s): Eleni Vrontaki,Georgia Melagraki,Stella Voskou,Marios S. Phylactides,Thomas Mavromoustakos,Marina Kleanthous,Antreas Afantitis

Research Article

Structural Investigation of Vinca Domain Tubulin Binders by Pharmacophore, Atom based QSAR, Docking and Molecular Dynamics Simulations

Journal: Combinatorial Chemistry & High Throughput Screening
Volume: 20 Issue: 8 Year: 2017 Page: 682-695
Author(s): Mohd Athar,Mohsin Y. Lone,Vijay M. Khedkar,Ashish Radadiya,Anamik Shah,Prakash C. Jha

Research Article

Combined 3D-QSAR, Pharmacophore and Docking Studies on Benzenesulfonamide Derivatives as Potent 12-Lipoxygenase Inhibitors

Journal: Letters in Drug Design & Discovery
Volume: 14 Issue: 1 Year: 2017 Page: 74-82
Author(s): Chunhong An,Mao Shu,Xiaoli Zai,Beina Zhang,Jing Li,Zichao Chang,Yong Hu,Zhihua Lin

Research Article

Validation of TZD Scaffold as Potential ARIs: Pharmacophore Modeling, Atom-based 3D QSAR and Docking Studies

Journal: Combinatorial Chemistry & High Throughput Screening
Volume: 20 Issue: 4 Year: 2017 Page: 310-320
Author(s): Lalita Dahiya,Manoj Kumar Mahapatra,Ramandeep Kaur,Vipin Kumar,Manoj Kumar

Research Article

2D Pharmacophoric Design and Synthesis of Novel Pyrimidine Derivatives as Anticonvulsants

Journal: Current Bioactive Compounds
Volume: 13 Issue: 2 Year: 2017 Page: 130-136
Author(s): Chhanda C. Danta,Satya B. Sahu,Trupti R. Swain

Research Article

Computational Studies of N-substituted Quinolinonyl Diketo Acid Derivatives as HIV Integrase Strand Transfer Inhibitors using 3D-QSAR, Pharmacophore Modeling and Molecular Docking

Journal: Letters in Drug Design & Discovery
Volume: 14 Issue: 11 Year: 2017 Page: 1291-1302
Author(s): Yuming Luo,Yujie Ren,Xiaodong Gao

Research Article

Mechanistic Approach to Explore Isoniazid Derivatives as Antitubercular Agents Using KNN-MF Based-QSAR Analysis, Pharmacophore Modeling and Molecular Docking

Journal: Current Drug Therapy
Volume: 12 Issue: 2 Year: 2017 Page: 97-114
Author(s): Ekta Verma,Shivangi Agarwal,Shailendra Patil,Sushil K. Kashaw,Asmita Gajbhiye

Research Article

Computational Screening of CCR5 Inhibitors as Potential Entry Inhibitor Microbicides Using 3D-QSAR Studies, Docking and Molecular Dynamics Simulation

Journal: Current HIV Research
Volume: 15 Issue: 4 Year: 2017 Page: 234-244
Author(s): Radhika Ramachandran,Muthusankar Aathi,Durairaj D. Ruban,Shanmughavel Piramanyagam

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