Search Result "experimental de novo design"


Computational Approaches for Fragment-Based and De Novo Design

Journal: Current Topics in Medicinal Chemistry
Volume: 10 Issue: 1 Year: 2010 Page: 14-32
Author(s): Kathryn Loving, Ian Alberts, Woody Sherman

Current Frontiers

Artificial Intelligence in De Novo Drug Design: Are We Still There?

Journal: Current Topics in Medicinal Chemistry
Volume: 22 Issue: 30 Year: 2022 Page: 2483-2492
Author(s): Ghulam Md Ashraf

Towards an Experimental de Novo Design Protocol. The use of Protein Crystallography to Deconvolute Dynamic Combinatorial Processes

Journal: Letters in Drug Design & Discovery
Volume: 1 Issue: 2 Year: 2004 Page: 173-177
Author(s): Robert E. Babine, Michael J. Rynkiewicz, Lei Jin, Sherin S. Abdel-Meguid

FBDD & De Novo Drug Design

Ebook: Applied Computer-Aided Drug Design: Models and Methods
Volume: 1 Year: 2023
Author(s):
Doi: 10.2174/9789815179934123010008

Revisiting De Novo Drug Design: Receptor Based Pharmacophore Screening

Journal: Current Topics in Medicinal Chemistry
Volume: 14 Issue: 16 Year: 2014 Page: 1890-1898
Author(s): Harikishore Amaravadhi,Kwanghee Baek,Ho Sup Yoon

Structural Bioinformatics and Artificial Intelligence Approaches in De Novo Drug Design

Ebook: Marvels of Artificial and Computational Intelligence in Life Sciences
Volume: 1 Year: 2023
Author(s):
Doi: 10.2174/9789815136807123010008

IVGA3D: De Novo Ligand Design Using a Variable Sized Tree Representation

Journal: Protein & Peptide Letters
Volume: 17 Issue: 1 Year: 2010 Page: 1495-1516
Author(s): Sanghamitra Bandyopadhyay, Soumi Sengupta

Recent Developments in Computational Methods for De Novo Peptide Sequencing from Tandem Mass Spectrometry (MS/MS)

Journal: Protein & Peptide Letters
Volume: 22 Issue: 11 Year: 2015 Page: 983-991
Author(s): Yan Yan,Anthony J. Kusalik,Fang-Xiang Wu

An Overview of the De Novo Prediction of Enzyme Catalytic Residues (Supplementry file)

Journal: Current Bioinformatics
Volume: 4 Issue: 3 Year: 2009 Page: 197-206
Author(s): Ziding Zhang, Yu-Rong Tang, Zhi-Ya Sheng, Dongbin Zhao

Computer-Aided Perspective for the Design of Flexible HIV Non- Nucleoside Reverse Transcriptase Inhibitors (NNRTIs): de-novo Drug Design, Virtual Screening and Molecular Dynamics Simulations

Journal: Letters in Drug Design & Discovery
Volume: 11 Issue: 4 Year: 2014 Page: 513-524
Author(s): Suri Moonsamy,Mahmoud E. S. Soliman

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