Search Result "Protein-ligand interaction fingerprints"


Quantitative Chemogenomics: Machine-Learning Models of Protein-Ligand Interaction

Journal: Current Topics in Medicinal Chemistry
Volume: 11 Issue: 1 Year: 2011 Page: 1978-1993
Author(s): Claes R. Andersson, Mats G. Gustafsson, Helena Strombergsson

Protein Ligand Complex Guided Approach for Virtual Screening

Journal: Combinatorial Chemistry & High Throughput Screening
Volume: 18 Issue: 6 Year: 2015 Page: 577-590
Author(s): Muthukumarasamy Karthikeyan,Deepak Pandit,Renu Vyas

Predicting Protein-Ligand Interactions Based on Chemical Preference Features with its Application to New D-Amino Acid Oxidase Inhibitor Discovery

Journal: Current Pharmaceutical Design
Volume: 20 Issue: 32 Year: 2014 Page: 5202-5211
Author(s): Mingzhu Zhao,Hao-Teng Chang,Qiang Zhou,Tao Zeng,Chung-Shiuan Shih,Zhi-Ping Liu,Luonan Chen,Dong-Qing Wei

Calculating the Protonation States of Proteins and Small Molecules: Implications to Ligand-Receptor Interactions

Journal: Current Computer-Aided Drug Design
Volume: 4 Issue: 3 Year: 2008 Page: 169-179
Author(s): Rooplekha Mitra, Radhey Shyam, Indranil Mitra, Maria A. Miteva, Emil Alexov

Explicit Treatment of Water Molecules in Protein-Ligand Docking

Journal: Current Computer-Aided Drug Design
Volume: 5 Issue: 3 Year: 2009 Page: 145-154
Author(s): Oscar Villacanas, Sergio Madurga, Ernest Giralt, Ignasi Belda

Reverse Fingerprinting and Mutual Information-Based Activity Labeling and Scoring (MIBALS)

Journal: Combinatorial Chemistry & High Throughput Screening
Volume: 12 Issue: 4 Year: 2009 Page: 424-439
Author(s): Chris Williams, Suzanne K. Schreyer

Monitoring Intermolecular and Intramolecular Interactions by NMR Spectroscopy

Ebook: Applications of NMR Spectroscopy
Volume: 3 Year: 2015
Author(s): Juliana Fattori,Fábio H.S. Rodrigues,João G.M. Pontes,Ana Paula Espíndola,Ljubica Tasic
Doi: 10.2174/9781681080628115030008

The Relevance of Protein-Ligand Interaction Profiles in Computer-Aided Novel Compound Design and Applications

Journal: Current Bioinformatics
Volume: 6 Issue: 3 Year: 2011 Page: 383-388
Author(s): Daniel L. Clinciu, Jinn-Moon Yang, Kai-Cheng Hsu, Chi-Chun Lo, Steve Wallace, Hsiao-Cheng Yu

Mass Spectrometry for Studying the Interaction between Small Molecules and Proteins

Journal: Current Proteomics
Volume: 5 Issue: 1 Year: 2008 Page: 20-34
Author(s): Enrique Calvo, Emilio Camafeita, J. Fernando Diaz, Juan Antonio Lopez

NMR as a Tool for Exploring Protein Interactions and Dynamics

Ebook: Applications of NMR Spectroscopy
Volume: 8 Year: 2020
Author(s): Qamar Bashir,Naeem Rashid
Doi: 10.2174/9789811439971120080008

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