Search Result "QSPR"


Research Article

Statistical Study on Relationship between Structural Properties and Mesomorphic Properties of Some Ester Linkage Mesomorphic Compounds

Journal: Current Physical Chemistry
Volume: 11 Issue: 0 Year: 2021 Page: 1-10
Author(s): Jwalant Travadi

Research Article

Computer Assisted Models for Blood Brain Barrier Permeation of 1, 5-Benzodiazepines

Journal: Current Computer-Aided Drug Design
Volume: 17 Issue: 2 Year: 2021 Page: 187-200
Author(s): Rakesh P. Dhavale,Prafulla B. Choudhari,Manish S. Bhatia

Research Article

Quantitative Structure-Property Relationship Study for Prediction of BoilingPoint and Enthalpy of Vaporization of Alkenes

Journal: Current Computer-Aided Drug Design
Volume: 17 Issue: 6 Year: 2021 Page: 725-738
Author(s): Fatemeh Ghaemdoost,Fatemeh Shafiei

Research Article

Quantitative Structure Activity/pharmacokinetics Relationship Studies of HIV-1 Protease Inhibitors Using Three Modelling Methods

Journal: Medicinal Chemistry
Volume: 17 Issue: 4 Year: 2021 Page: 396-406
Author(s): Dan Han,Jianjun Tan,Jingrui Men,Chunhua Li,Xiaoyi Zhang

Research Article

On the Edge-version of Topological Indices of Titanium Dioxide Nanotube and Nanosheet

Journal: Nanoscience & Nanotechnology-Asia
Volume: 11 Issue: 2 Year: 2021 Page: 174-188
Author(s): S. Prabhu,G. Murugan,M. Arulperumjothi

Review Article

Computation and Analysis of Topological Co-Indices for Metal-Organic Compound

Journal: Current Organic Synthesis
Volume: 18 Issue: 0 Year: 2021 Page: 1-11
Author(s): Dongming Zhao,Mehwish Hussain Muhammad,Muhammad Kamran Siddiqui,Muhammad Nasir,Muhammad Faisal Nadeem,Muhammad Farhan Hanif

Research Article

QSAR to Design an Effective Eco-friendly Inhibitor Model from Chitosan Derivatives Sea-food Waste based on DFT Calculations and Experimental Study

Journal: Current Chinese Chemistry
Volume: 1 Issue: 1 Year: 2021 Page: 56-71
Author(s): Doaa S. El Sayed,Mohamed A. Makhyoun

Research Article

Removal of Targeted Pharmaceuticals and Personal Care Products from Wastewater Treatment Plants using QSAR Model

Journal: Current Analytical Chemistry
Volume: 17 Issue: 7 Year: 2021 Page: 1003-1015
Author(s): Lavanya Madhura,Shalini Singh,Suvardhan Kanchi,Myalowenkosi I. Sabela,Krishna Bisetty,Inamuddin

Review Article

Machine Learning and Perturbation Theory Machine Learning (PTML) in Medicinal Chemistry, Biotechnology, and Nanotechnology

Journal: Current Topics in Medicinal Chemistry
Volume: 21 Issue: 7 Year: 2021 Page: 649-660
Author(s): Diana M. Herrera-Ibatá

Research Article

In Silico Drug Design: Development of New Pyrimidine-based Benzothiazole Derivatives, Selective for CDK2

Journal: Letters in Drug Design & Discovery
Volume: 18 Issue: 0 Year: 2021 Page: 1-15
Author(s): Rania Kasmi,Larbi Elmchichi,Abdellah El Aissouq,Mohammed Bouachrine,Abdelkrim Ouammou

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