Search Result "MMFF"
Hybrid Quantum Mechanics/Molecular Mechanics (QM/MM) Simulation:A Tool for Structure-Based Drug Design and Discovery
Journal: Mini-Reviews in Medicinal Chemistry
Volume: 22 Issue: 8 Year: 2022 Page: 1096-1107
Author(s): Vivek K. Vyas,Prajakta U. Kulkarni
Arylsulfonylhydrazone Induced Apoptosis in MDA-MB-231 Breast Cancer Cells
Journal: Letters in Drug Design & Discovery
Volume: 15 Issue: 1 Year: 2018 Page: 1288-1298
Author(s): Thais Batista Fernandes,Ricardo Alexandre de Azevedo,Rosania Yang,Sarah Fernandes Teixeira,Gustavo Henrique Goulart Trossini,Jose Alexandre Marzagao Barbuto,Adilson Kleber Ferreira,Roberto Parise-Filho
Towards Consistency in Geometry Restraints for Carbohydrates inthe Pyranose form: Modern Dictionary Generators Reviewed
Journal: Current Medicinal Chemistry
Volume: 29 Issue: 7 Year: 2022 Page: 1193-1207
Author(s): Robbie P. Joosten,Robert A. Nicholls,Jon Agirre
3D-QSAR and Docking Studies on a Series of Benzothiadiazine Derivatives as Genotype 1 HCV Polymerase Inhibitors
Journal: Medicinal Chemistry
Volume: 8 Issue: 6 Year: 2012 Page: 1099-1107
Author(s): Vaishali M. Patil, Satya Prakash Gupta, Subeer Samanta, Neeraj Masand
Homology Modeling of MDR1 Gene MDR1_ENTHI of E. histolytica & its Molecular Docking with Anti-Entamoeba Histolytica Agents
Journal: Current Topics in Medicinal Chemistry
Volume: 15 Issue: 11 Year: 2015 Page: 980-989
Author(s): Rajeev K. Singla
Combined Approach of QSAR and Docking Studies for the Design of Local Anaesthetic Agents
Journal: Combinatorial Chemistry & High Throughput Screening
Volume: 20 Issue: 3 Year: 2017 Page: 272-276
Author(s): Chunyan Zhang,Zhi Li,Jiahai Ma,Jing Zhang,Longming Zhang,Tao Li,Shijian Zheng
Optimization of Pharmacophore of Novel Hybrid Nucleus of 1,3,4-oxadiazole-chalcone using Literature Findings and In silico Approach asEGFR Inhibitor
Journal: Letters in Drug Design & Discovery
Volume: 20 Issue: 6 Year: 2023 Page: 779-791
Author(s): Shital M. Patil,Shashikant V. Bhandari
Exploration of Novel 5α-Reductase Inhibitors for Benign Prostatic Hyperplasia by 2D/3D QSAR, Cytotoxicity Pre-ADME and Docking Studies
Journal: Current Topics in Medicinal Chemistry
Volume: 18 Issue: 32 Year: 2018 Page: 2816-2834
Author(s): Richa Dhingra,Manav Malhotra,Vivek Sharma,T.R. Bhardwaj,Neelima Dhingra
Design, Synthesis and Evaluation of Antibacterial Activity of Novel Indazole Derivatives
Journal: Current Bioactive Compounds
Volume: 9 Issue: 4 Year: 2013 Page: 263-269
Author(s): Anuruddha Chabukswar,Bhanudas Kuchekar,Pradeep Lokhande,Mangesh Tryambake,Bharat Pagare,Vinayak Kadam,Swati Jagdale,Vasant Chabukswar