Search Result "docking sites"


Research Article

Characterization of the Trypanosoma brucei Pteridine Reductase Active- Site using Computational Docking and Virtual Screening Techniques

Journal: Current Computer-Aided Drug Design
Volume: 16 Issue: 5 Year: 2020 Page: 583-598
Author(s): Hina Shamshad,Abdul Hafiz,Ismail I. Althagafi,Maria Saeed,Agha Zeeshan Mirza

General Review Article

Docking Techniques in Toxicology: An Overview

Journal: Current Bioinformatics
Volume: 15 Issue: 6 Year: 2020 Page: 600-610
Author(s): Meenakshi Gupta,Ruchika Sharma,Anoop Kumar

Review Article

Covalent Docking in Drug Discovery: Scope and Limitations

Journal: Current Pharmaceutical Design
Volume: 26 Issue: 4 Year: 2020 Page: 5684-5699
Author(s): Andrea Scarpino,György G. Ferenczy,György M. Keserű

Research Article

Integrated Cheminformatics-Molecular Docking Approach to Drug Discovery Against Viruses

Journal: Infectious Disorders - Drug Targets
Volume: 20 Issue: 2 Year: 2020 Page: 150-159
Author(s): Muhammad Faraz Anwar,Ramsha Khalid,Alina Hasanain,Sadaf Naeem,Shamshad Zarina,Syed Hani Abidi,Syed Ali

Research Article

In silico Evaluation of Substrate Binding Site and Rare Codons in the Structure of CYP152A1

Journal: Current Proteomics
Volume: 17 Issue: 1 Year: 2020 Page: 10-22
Author(s): Mojtaba Mortazavi,Navid Nezafat,Manica Negahdaripour,Mohammad J. Raee,Masoud Torkzadeh-Mahani,Ali Riahi-Madvar,Younes Ghasemi

Research Article

Structure Based Drug Design and Molecular Docking Studies of Anticancer Molecules Paclitaxel, Etoposide and Topotecan using Novel Ligands

Journal: Current Drug Discovery Technologies
Volume: 17 Issue: 2 Year: 2020 Page: 183-190
Author(s): J.Satya Eswari,Manisha Yadav,Swasti Dhagat

Research Article

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

Research Article

Hydroxyenone Derivatives: In vitro Anti-malarial and Docking Studies against P. falciparum

Journal: Infectious Disorders - Drug Targets
Volume: 20 Issue: 2 Year: 2020 Page: 237-243
Author(s): Aarti Dalal,Parvin Kumar,Radhika Khanna,Dinesh Kumar,Deepika Paliwal,Ramesh C. Kamboj

Research Article

Evaluation of Cytotoxic and Tyrosinase Inhibitory Activities of 2-phenoxy(thiomethyl) pyridotriazolopyrimidines: In Vitro and Molecular Docking Studies

Journal: Anti-Cancer Agents in Medicinal Chemistry
Volume: 20 Issue: 1 Year: 2020 Page: 1714-1721
Author(s): Hatem A. Abuelizz,El Hassane Anouar,Mohamed Marzouk,Mizaton H. Hasan,Siti R. Saleh,Adi Ahudhaif,Khalid A. Alburikan,Rashad Al-Salahi

Research Article

Three Major Phosphoacceptor Sites in HIV-1 Capsid Protein Enhances its Structural Stability and Resistance Against the Inhibitor: Explication Through Molecular Dynamics Simulation, Molecular Docking and DFT Analysis

Journal: Combinatorial Chemistry & High Throughput Screening
Volume: 23 Issue: 1 Year: 2020 Page: 41-54
Author(s): Nouman Rasool,Waqar Hussain

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