Protein pocket and ligand shape comparison and its application in virtual screening.
about
Stereoselective virtual screening of the ZINC database using atom pair 3D-fingerprintsPDB-Explorer: a web-based interactive map of the protein data bank in shape spacePOVME 2.0: An Enhanced Tool for Determining Pocket Shape and Volume Characteristicsp38α MAPK and Type I Inhibitors: Binding Site Analysis and Use of Target Ensembles in Virtual Screening.On the origins of three-dimensionality in drug-like molecules.Improvements, trends, and new ideas in molecular docking: 2012-2013 in review.Considerations of Protein Subpockets in Fragment-Based Drug Design.Drug-Like Protein-Protein Interaction Modulators: Challenges and Opportunities for Drug Discovery and Chemical Biology.Mapping the 3D structures of small molecule binding sites.
P2860
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P2860
Protein pocket and ligand shape comparison and its application in virtual screening.
description
2013 nî lūn-bûn
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2013年の論文
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2013年学术文章
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2013年学术文章
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2013年学术文章
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2013年学术文章
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2013年学术文章
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2013年学术文章
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2013年學術文章
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2013年學術文章
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name
Protein pocket and ligand shape comparison and its application in virtual screening.
@en
Protein pocket and ligand shape comparison and its application in virtual screening.
@nl
type
label
Protein pocket and ligand shape comparison and its application in virtual screening.
@en
Protein pocket and ligand shape comparison and its application in virtual screening.
@nl
prefLabel
Protein pocket and ligand shape comparison and its application in virtual screening.
@en
Protein pocket and ligand shape comparison and its application in virtual screening.
@nl
P2093
P2860
P50
P1476
Protein pocket and ligand shape comparison and its application in virtual screening
@en
P2093
Friedrich Rippmann
Matthias Wirth
Olivier Michielin
Vincent Zoete
P2860
P2888
P304
P356
10.1007/S10822-013-9659-1
P577
2013-06-27T00:00:00Z