Search Result "Molecular docking"


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

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

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

Synthesis, Molecular Docking Study, and Cytotoxic Activity of 1,3,5-triaryl Pyrazole Derivatives

Journal: Letters in Drug Design & Discovery
Volume: 13 Issue: 2 Year: 2016 Page: 121-128
Author(s): Maryam Ghasemi,Sajad Ghadbeighi,Amirali Amirhamzeh,Seyed AbbasTabatabai,Seyed Nasser Ostad,Abbas Shafiee,Mohsen Amini

Research Article

Design of Novel Chemotherapeutic Agents Targeting Checkpoint Kinase 1 Using 3D-QSAR Modeling and Molecular Docking Methods

Journal: Current Computer-Aided Drug Design
Volume: 12 Issue: 4 Year: 2016 Page: 302-313
Author(s): Anand Balupuri, Pavithra K. Balasubramanian, Seung J. Cho

Research Article

Molecular Dynamics Simulation and Docking Studies of Selenocyanate Derivatives as Anti-Leishmanial Agents

Journal: Combinatorial Chemistry & High Throughput Screening
Volume: 19 Issue: 10 Year: 2016 Page: 847-854
Author(s): Maryam Iman,Hamid Bakhtiari Kaboutaraki,Rahim Jafari,Seyed Ayoub Hosseini,Abolghasem Moghimi,Ali Khamesipour,Asghar Beigi Harchegani,Asghar Davood

CoMFA/CoMSIA and Molecular Docking Studies of Novel Matrix Metalloproteinase- 2 Inhibitors Based on L-tyrosine Scaffold

Journal: Letters in Drug Design & Discovery
Volume: 13 Issue: 5 Year: 2016 Page: 376-386
Author(s): Jun-Zhang,Xue-Jiao Wang,Zhen-Ke Dong,Shu-Qing Wang,Wei-Ren Xu,Jing-Wei Fu,Xian- Chao Cheng,Run-Ling Wang

Synthesis, Antibacterial Activity, Interaction with Nucleobase and Molecular Docking Studies of 4-Formylbenzoic Acid Based Thiazoles

Journal: Medicinal Chemistry
Volume: 12 Issue: 6 Year: 2016 Page: 553-562
Author(s): Krzysztof Z. Laczkowski, Anna Biernasiuk, Angelika Baranowska-Laczkowska, Konrad Misiura, Anna Malm, Tomasz Plech, Agata Paneth

Research Article

Docking, Molecular Dynamics Simulation and Synthesis of New Fenobam Analogues as mGlu5 Receptor Antagonists

Journal: Combinatorial Chemistry & High Throughput Screening
Volume: 19 Issue: 9 Year: 2016 Page: 764-770
Author(s): Abdollah Javidan,Mohammad Javad Taghizadeh,Seyed Ayoub Hosseini,Maryam Iman,Rahim Jafari

Research Article

Identification of Novel Structurally Diverse Anaplastic Lymphoma Kinase Inhibitors Based on Pharmacophore Modeling, Virtual Screening and Molecular Docking

Journal: Combinatorial Chemistry & High Throughput Screening
Volume: 19 Issue: 9 Year: 2016 Page: 691-704
Author(s): Rong You,Lu Zhou,Liangliang Zhong,Xiaoli Li,Suwen Zhou,Yahui Tian

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