Search Result "drugscore"


Evaluation of Molecular Docking Using Polynomial Empirical Scoring Functions

Journal: Current Drug Targets
Volume: 9 Issue: 1 Year: 2008 Page: 1062-1070
Author(s): Raquel Dias, Luis Fernando Saraiva Macedo Timmers, Rafael Andrade Caceres, Walter Filgueira de Azevedo Jr.

Research Article

Some Flavolignans as Potent Sars-Cov-2 Inhibitors via Molecular Docking,Molecular Dynamic Simulations and ADME Analysis

Journal: Current Computer-Aided Drug Design
Volume: 18 Issue: 5 Year: 2022 Page: 337-346
Author(s):

Research Article

Design, Synthesis, and Biological Evaluation of Vanillin Hydroxamic Acid Derivatives as Novel Peptide Deformylase Inhibitors

Journal: Current Computer-Aided Drug Design
Volume: 14 Issue: 1 Year: 2018 Page: 95-101
Author(s): Jian Gao,Shengzhi Qiu,Li Liang,Zhixiang Hao,Qianqian Zhou,Fanfan Wang,Jie Mou,Qisi Lin

Research Article

Molecular Docking and Pharmacokinetic Studies of Aquillochin andGrewin as SARS-CoV-2 Mpro Inhibitors

Journal: Drug Delivery Letters
Volume: 12 Issue: 1 Year: 2022 Page: 54-61
Author(s):

Research Article

Synthesis, Anticlotting and Antiplatelet Effects of 1,2,3-Triazoles Derivatives

Journal: Medicinal Chemistry
Volume: 12 Issue: 8 Year: 2016 Page: 733-741
Author(s): Laura de A. Moura,Ana C. M. de Almeida,Andreza V. da Silva,Vivian R. de Souza,Vitor F. Ferreira,Michel V. Menezes,Carlos R. Kaiser,Sabrina B. Ferreira,André L. Fuly

Modulating Protein-Protein Interactions: From Structural Determinants of Binding to Druggability Prediction to Application

Journal: Current Pharmaceutical Design
Volume: 18 Issue: 30 Year: 2012 Page: 4630-4647
Author(s): Alexander Metz,Emanuele Ciglia,Holger Gohlke

Identification of New Inhibitors for Human SIRT1: An in-silico Approach

Journal: Medicinal Chemistry
Volume: 12 Issue: 4 Year: 2016 Page: 347-361
Author(s): Balasundaram Padmanabhan,Manjula Ramu,Shruti Mathur,Sruthi Unni,Saravanamuthu Thiyagarajan

Computational Methods for Calculation of Ligand-Binding Affinity

Journal: Current Drug Targets
Volume: 9 Issue: 1 Year: 2008 Page: 1031-1039
Author(s): Walter Filgueira de Azevedo Jr., Raquel Dias

Recent Development and Application of Virtual Screening in Drug Discovery: An Overview

Journal: Current Pharmaceutical Design
Volume: 10 Issue: 9 Year: 2004 Page: 1011-1033
Author(s): Tingjun Hou, Xiaojie Xu

Scoring Functions for Prediction of Protein-Ligand Interactions

Journal: Current Pharmaceutical Design
Volume: 19 Issue: 12 Year: 2013 Page: 2174-2182
Author(s): Jui-Chih Wang,Jung-Hsin Lin

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