Search Result "Multidimensional generalized-ensemble algorithm"


Generalized-Ensemble Algorithms for Protein Folding and Unfolding

Journal: Current Physical Chemistry
Volume: 2 Issue: 1 Year: 2012 Page: 92-106
Author(s): Yuko Okamoto

Drug Design by Generalized-Ensemble Simulations

Journal: Current Pharmaceutical Design
Volume: 17 Issue: 1 Year: 2011 Page: 1758-1772
Author(s): Yuko Okamoto

Recent Advances in Multidimensional QSAR (4D-6D): A Critical Review

Journal: Mini-Reviews in Medicinal Chemistry
Volume: 14 Issue: 1 Year: 2014 Page: 35-55
Author(s): Manoj G. Damale,Sanjay N. Harke,Firoz A. Kalam Khan,Devanand B. Shinde,Jaiprakash N. Sangshetti

Artificial Neural Networks for Efficient Clustering of Conformational Ensembles and their Potential for Medicinal Chemistry

Journal: Current Topics in Medicinal Chemistry
Volume: 13 Issue: 5 Year: 2013 Page: 642-651
Author(s): Alessandro Pandini, Domenico Fraccalvieri, Laura Bonati

A Review on Modelling Methods, Pathway Simulation Software and Recent Development on Differential Evolution Algorithms for Metabolic Pathways in Systems Biology

Journal: Current Bioinformatics
Volume: 9 Issue: 5 Year: 2014 Page: 509-521
Author(s): Chuii Khim Chong,Mohd Saberi Mohamad,Safaai Deris,Mohd Shahir Shamsir,Yee Wen Choon,Lian En Chai

Discovery of Novel HIV-1 Integrase Inhibitors Using QSAR-Based Virtual Screening of the NCI Open Database

Journal: Current Computer-Aided Drug Design
Volume: 12 Issue: 2 Year: 2016 Page: 135-153
Author(s): Gene M. Ko,Rajni Garg,Barbara A. Bailey,Sunil Kumar

Review Article

How to Collect and Interpret Medical Pictures Captured in HighlyChallenging Environments that Range from Nanoscale to HyperspectralImaging

Journal: Current Medical Imaging
Volume: 20 Issue: 1 Year: 2024 Page: 1-10
Author(s): Asif A. Laghari,Vania V. Estrela

Review Article

Survey on the Techniques for Classification and Identification of BrainTumour Types from MRI Images Using Deep Learning Algorithms

Journal: Recent Advances in Computer Science and Communications
Volume: 16 Issue: 9 Year: 2023 Page: 11-26
Author(s): Gayathri Devi K.

The Receptor-Dependent QSAR Paradigm: An Overview of the Current State of the Art

Journal: Medicinal Chemistry
Volume: 5 Issue: 4 Year: 2009 Page: 359-366
Author(s): Osvaldo A. Santos-Filho, Anton J. Hopfinger, Artem Cherkasov, Ricardo Bicca de Alencastro

Role of Ensemble Conformational Sampling Using Molecular Docking & Dynamics in Drug Discovery

Ebook: Frontiers in Computational Chemistry
Volume: 6 Year: 2022
Author(s):
Doi: 10.2174/9789815036848122060004

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