Concepedia

A combined molecular docking-based and pharmacophore-based target prediction strategy with a probabilistic fusion method for target ranking

Guo‐Bo Li, Lingling Yang, Yong Xu, Wenjing Wang, Linli Li, Shengyong Yang

Journal of Molecular Graphics and Modelling · 2013 · 20 citations · 32 references

DOI

Concepts

References

32

The Protein Data Bank

Helen M. Berman · Nucleic Acids Research · 2000 · 39.8K citations

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<scp>CHARMM</scp>: A program for macromolecular energy, minimization, and dynamics calculations

Bernard R. Brooks, Robert E. Bruccoleri, Barry D. Olafson et al. · Journal of Computational Chemistry · 1983 · 14.9K citations

, , +13

Development and validation of a genetic algorithm for flexible docking 1 1Edited by F. E. Cohen

Gareth Jones, Peter Willett, Robert C. Glen et al. · Journal of Molecular Biology · 1997 · 6.7K citations

, , +14

Upper and Lower Probabilities Induced by a Multivalued Mapping

A. P. Dempster · The Annals of Mathematical Statistics · 1967 · 6K citations · Full text

, , +11

ZINC − A Free Database of Commercially Available Compounds for Virtual Screening

John J. Irwin, Brian K. Shoichet · Journal of Chemical Information and Modeling · 2004 · 4.1K citations · Full text

, , +15