Search Result "Atom based QSAR"


Exploring QSAR of Flavonoids as Scavengers of Peroxynitrite Using Electrotopological State (E-State) Atom Parameter

Journal: Letters in Drug Design & Discovery
Volume: 7 Issue: 8 Year: 2010 Page: 618-624
Author(s): Supratim Ray

Ligand-Based Pharmacophore Modeling, Atom-Based 3D-QSAR and Molecular Docking Studies on Substituted Thiazoles and Thiophenes as Polo-Like Kinase 1 (Plk1) Inhibitors

Journal: Combinatorial Chemistry & High Throughput Screening
Volume: 17 Issue: 10 Year: 2014 Page: 848-858
Author(s): Rajasekhar Chekkara,Venkata Reddy Gorla,Ethiraj Susithra,Sobha Rani Tenkayala

Research Article

Atom-based and Pharmacophore-based 3D – QSAR Studies on Vitamin D Receptor (VDR)

Journal: Combinatorial Chemistry & High Throughput Screening
Volume: 21 Issue: 5 Year: 2018 Page: 329-343
Author(s): Selvaraman Nagamani,Chandrasekhar Kesavan,Karthikeyan Muthusamy

Receptor-based 3D-QSAR in Drug Design: Methods and Applications in Kinase Studies

Journal: Current Topics in Medicinal Chemistry
Volume: 16 Issue: 13 Year: 2016 Page: 1463-1477
Author(s): Cheng Fang,Zhiyan Xiao

Research Article

Atom Based 3D-QSAR, Molecular Docking and Density Functional Theory Approaches to Identify Novel JNK-1 Inhibitor

Journal: Combinatorial Chemistry & High Throughput Screening
Volume: 19 Issue: 9 Year: 2016 Page: 771-797
Author(s): Ramanathan Shylaja,Rengarajan Kavitha,Chandrasekaran Meganathan

Pharmacophore Modeling, Atom Based 3D-QSAR and Docking Studies of Protein Tyrosine Phosphatase 1B Inhibitors

Journal: Letters in Drug Design & Discovery
Volume: 10 Issue: 4 Year: 2013 Page: 303-319
Author(s): Priyanka Malla, Rajnish Kumar, Manoj Kumar

Research Article

Structural Investigation of Vinca Domain Tubulin Binders by Pharmacophore, Atom based QSAR, Docking and Molecular Dynamics Simulations

Journal: Combinatorial Chemistry & High Throughput Screening
Volume: 20 Issue: 8 Year: 2017 Page: 682-695
Author(s): Mohd Athar,Mohsin Y. Lone,Vijay M. Khedkar,Ashish Radadiya,Anamik Shah,Prakash C. Jha

Research Article

Validation of TZD Scaffold as Potential ARIs: Pharmacophore Modeling, Atom-based 3D QSAR and Docking Studies

Journal: Combinatorial Chemistry & High Throughput Screening
Volume: 20 Issue: 4 Year: 2017 Page: 310-320
Author(s): Lalita Dahiya,Manoj Kumar Mahapatra,Ramandeep Kaur,Vipin Kumar,Manoj Kumar

A Neural Network-Based QSAR Approach for Exploration of Diverse Multi-Tyrosine Kinase Inhibitors and its Comparison with a Fragment- Based Approach

Journal: Current Computer-Aided Drug Design
Volume: 9 Issue: 4 Year: 2013 Page: 482-490
Author(s): Subhash Ajmani,Vellarkad N. Viswanadhan

Analysis of Proteasome Inhibition Prediction Using Atom-Based Quadratic Indices Enhanced by Machine Learning Classification Techniques

Journal: Letters in Drug Design & Discovery
Volume: 11 Issue: 6 Year: 2014 Page: 705-711
Author(s): Gerardo M. Casanola-Martin,Huong Le-Thi-Thu,Yovani Marrero-Ponce,Juan A Castillo- Garit,Francisco Torrens,Facundo Perez-Gimenez,Concepcion Abad

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