Ligand Flexibility is a computational property in molecular docking that characterizes the capacity of a ligand to undergo conformational changes during binding to a protein target, distinguishing it from rigid-body docking approaches by explicitly accounting for rotational bonds and three-dimensional structural adaptability.
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2017–2026
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804
Centre National de la Recherche Scientifique
Paris, France
17 h-index
111 publications
2.7K citations
Scripps Research Institute
San Diego, United States
14 h-index
43 publications
9.4K citations
Chinese Academy of Sciences
Beijing, China
14 h-index
76 publications
4.3K citations
University of California, San Francisco
San Francisco, United States
13 h-index
42 publications
14.5K citations
University of Cambridge
Cambridge, United Kingdom
11 h-index
37 publications
2.2K citations
Fujian Institute of Research on the Structure of Matter
Fuzhou, China
11 h-index
55 publications
3.3K citations
Nanjing University
Nanjing, China
10 h-index
22 publications
706 citations
Technical University of Munich
Munich, Germany
9 h-index
24 publications
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- Journal of the American Chemical Society
JACS · 37 publications · 3.1K citations
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- Journal of Chemical Information and Modeling
JCIM · 41 publications · 2.8K citations
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- Proteins Structure Function and Bioinformatics
32 publications · 6.1K citations
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- Journal of Computational Chemistry
25 publications · 2K citations
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- Inorganic Chemistry
36 publications · 1.2K citations
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