Search Result "SP and XP docking"
Consensus Docking in Drug Discovery
Journal: Current Bioactive Compounds
Volume: 16 Issue: 3 Year: 2020 Page: 182-190
Author(s): Giulio Poli,Tiziano Tuccinardi
Pharmacophore-Based 3D-QSAR Modeling, Virtual Screening and Molecular Docking Analysis for the Detection of MERTK Inhibitors with Novel Scaffold
Journal: Combinatorial Chemistry & High Throughput Screening
Volume: 19 Issue: 1 Year: 2016 Page: 73-96
Author(s): Suwen Zhou,Lu Zhou,Ruguo Cui,Yahui Tian,Xiaoli Li,Rong You,Liangliang Zhong
Water Mapping and Scoring Approaches to Predict the Role ofHydration Sites in the Binding Affinity of PAK1 Inhibitors
Journal: Combinatorial Chemistry & High Throughput Screening
Volume: 25 Issue: 4 Year: 2022 Page: 660-676
Author(s): Jayashree Biswal,Prajisha Jayaprakash,Suresh Kumar Rayala,Ganesh Venkatraman,Raghu Rangasamy,Saritha Poopandi
In silico Studies Toward the Discovery of Novel Type-II Inhibitors of TrkA: Pharmacophore-based 3D-QSAR Modeling, Database Screening and Molecular Docking
Journal: Letters in Drug Design & Discovery
Volume: 13 Issue: 6 Year: 2016 Page: 526-538
Author(s): Yahui Tian,Lu Zhou,Xiaoli Li,Suwen Zhou,Rong Yong,Liangliang Zhong
Molecular Docking: Principles, Advances, and Its Applications in DrugDiscovery
Journal: Letters in Drug Design & Discovery
Volume: 21 Issue: 3 Year: 2024 Page: 480-495
Author(s): Muhammed Tilahun Muhammed
Pharmacophore Based 3D-QSAR, Virtual Screening and Docking Studies on Novel Series of HDAC Inhibitors with Thiophen Linker as Anticancer Agents
Journal: Combinatorial Chemistry & High Throughput Screening
Volume: 19 Issue: 9 Year: 2016 Page: 735-751
Author(s): Preeti Patel,Avineesh Singh,Vijay K. Patel,Deepak K. Jain,Ravichandran Veerasamy,Harish Rajak
Identification of Novel β3-Adrenoceptor Agonists Using Energetic Analysis, Structure Based Pharmacophores and Virtual Screening
Journal: Combinatorial Chemistry & High Throughput Screening
Volume: 15 Issue: 8 Year: 2012 Page: 623-640
Author(s): Parul Tewatia,B.K. Malik,Shakti Sahi
Explicit Treatment of Water Molecules in Protein-Ligand Docking
Journal: Current Computer-Aided Drug Design
Volume: 5 Issue: 3 Year: 2009 Page: 145-154
Author(s): Oscar Villacanas, Sergio Madurga, Ernest Giralt, Ignasi Belda
Kaempferol as a Potential PAK4 Inhibitor in Triple Negative Breast Cancer: Extra Precision Glide Docking and Free Energy Calculation
Journal: Current Drug Discovery Technologies
Volume: 17 Issue: 5 Year: 2020 Page: 682-695
Author(s): Michael A. Arowosegbe,Oluwamuyiwa T. Amusan,Segun A. Adeola,Oluwatosin B. Adu,Israel A. Akinola,Bimpe F. Ogungbe,Olaposi I. Omotuyi,Gbemisola M. Saibu,Adewale J. Ogunleye,Ramon I. Kanmodi,Nekabari E. Lugbe,Oluwafemi J. Ogunmola,Damilola C. Ajayi,Sedoten O. Ogun,Faith O. Oyende,Ahmed O. Bello,Peter G. Ishola,Patrick E. Obasieke
A Cross-Docking Study on Matrix Metalloproteinase Family
Journal: Anti-Inflammatory & Anti-Allergy Agents in Medicinal Chemistry
Volume: 14 Issue: 3 Year: 2015 Page: 164-171
Author(s): Mohammad Ramezani,Jamal Shamsara