Search Result "Solvation"


Research Article

Determination of solute-solute and solute-solvent interaction of pyrimidine5-carbonitrile in aqueous DMSO at 298.15 K.

Journal: Current Physical Chemistry
Volume: 10 Issue: 0 Year: 2020 Page: 1-7
Author(s): Arun M. Bhagare,Manoj R. Gaware,Dnyneshawar D. Lokhande,Anant V. Kardel,Jayraj S. Aher

Review Article

Relevance of Molecular Docking Studies in Drug Designing

Journal: Current Bioinformatics
Volume: 15 Issue: 4 Year: 2020 Page: 270-278
Author(s): Ritu Jakhar,Mehak Dangi,Alka Khichi,Anil Kumar Chhillar

Research Article

Molecular insights into Resveratrol and its analogs as SARS-CoV-2 (COVID-19) protease inhibitors

Journal: Coronaviruses
Volume: 1 Issue: 0 Year: 2020 Page: 1-20
Author(s): Krishnan Balasubramanian,Rameshwar S. Cheke,Neeraj Masand,Rohan R. Narkhede,Vaishali M. Patil

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

Research Article

The Interaction of Isoflavone Phytoestrogens with ERα and ERβ by Molecular Docking and Molecular Dynamics Simulations

Journal: Current Computer-Aided Drug Design
Volume: 16 Issue: 0 Year: 2020 Page: 1-12
Author(s): Ting Wang,Yaquan Liu,Xuming Zhuang,Feng Luan,Chunyan Zhao

Review Article

A Better Understanding of Computational Models for Predicting DNA Methylation Effects at the Molecular Level

Journal: Current Topics in Medicinal Chemistry
Volume: 20 Issue: 1 Year: 2020 Page: 901-909
Author(s): Nathanael K. Proctor,Tugba Ertan-Bolelli,Kayhan Bolelli,Ethan W. Taylor,Norman H.L. Chiu,J. Phillip Bowen

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Journal: Letters in Drug Design & Discovery
Volume: 17 Issue: 4 Year: 2020 Page: 363-363
Author(s): Ricardo L. Mancera

Research Article

FRET Study between Carbon Quantum Dots and Malachite Green by Steady-State and Time-Resolved Fluorescence Spectroscopy

Journal: Current Physical Chemistry
Volume: 10 Issue: 3 Year: 2020 Page: 178-188
Author(s): Bipin Rooj,Ankita Dutta,Debojyoti Mukherjee,Sahidul Islam,Ujjwal Mandal

Research Article

1, 1’-Sulfinyldiethylammonium Bis (Hydrogen Sulfate) as a Recyclable Dicationic Ionic Liquid Catalyst for the Efficient Solvent-free Synthesis of 3, 4-Dihydropyrimidin-2(1H)-ones via Biginelli Reaction

Journal: Combinatorial Chemistry & High Throughput Screening
Volume: 23 Issue: 2 Year: 2020 Page: 157-167
Author(s): Zainab Ehsani-Nasab,Ali Ezabadi

General Review Article

Acetaminophen Oxidation and Inflammatory Markers – A Review of Hepatic Molecular Mechanisms and Preclinical Studies

Journal: Current Drug Targets
Volume: 21 Issue: 1 Year: 2020 Page: 1225-1236
Author(s): Silvio Terra Stefanello,Nelson Rodrigues de Carvalho,Simone Beder Reis,Felix Alexandre Antunes Soares,Rômulo Pillon Barcelos

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