Concepedia

SAHA-based novel HDAC inhibitor design by core hopping method

Lanlan Zang, Xuejiao Wang, Xiaobo Li, Shuqing Wang, Weiren Xu, Xie Xian-bin, Xian‐Chao Cheng, Huan Ma, Run‐Ling Wang

Journal of Molecular Graphics and Modelling · 2014 · 23 citations · 59 references

DOI

Concepts

References

59

Protein and ligand preparation: parameters, protocols, and influence on virtual screening enrichments

G. Madhavi Sastry, Matvey Adzhigirey, Tyler Day et al. · Journal of Computer-Aided Molecular Design · 2013 · 6K citations

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<i>PRODRG</i>: a tool for high-throughput crystallography of protein–ligand complexes

Alexander W. Schüttelkopf, Daan M. F. van Aalten · Acta Crystallographica Section D Biological Crystallography · 2004 · 4.8K citations · Full text

, , +16

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

Molecular basis of agonism and antagonism in the oestrogen receptor

A.M. Brzozowski, A.C.W. Pike, Zbigniew Dauter et al. · Nature · 1997 · 3.3K citations

, , +14

The Protein Data Bank

Helen M. Berman, Tammy Battistuz, Talapady N. Bhat et al. · Acta Crystallographica Section D Biological Crystallography · 2002 · 2.6K citations

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