PubChem3D: Shape compatibility filtering using molecular shape quadrupoles

Journal of Cheminformatics

Volumn 3, Issue 7, 2011, Pages

  Kim, Sunghwan ^a   Bolton, Evan E ^a   Bryant, Stephen H ^a  

^a NATIONAL INSTITUTES OF HEALTH   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

EID: 84862698741     PISSN: None     EISSN: 17582946     Source Type: Journal    
DOI: 10.1186/1758-2946-3-25     Document Type: Article

References (20)

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2. Wang YL, Xiao JW, Suzek TO, Zhang J, Wang JY, Bryant SH: PubChem: a public information system for analyzing bioactivities of small molecules. Nucleic Acids Res 2009, 37:W623-W633.
3. Wang YL, Bolton E, Dracheva S, Karapetyan K, Shoemaker BA, Suzek TO, Wang JY, Xiao JW, Zhang J, Bryant SH: An overview of the PubChem BioAssay resource. Nucleic Acids Res 2010, 38:D255-D266.
4. Sayers EW, Barrett T, Benson DA, Bolton E, Bryant SH, Canese K, Chetvernin V, Church DM, DiCuccio M, Federhen S, et al: Database resources of the National Center for Biotechnology Information. Nucleic Acids Res 2010, 38:D5-D16.
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7. Bolton EE, Kim S, Bryant SH: PubChem3D: similar conformers. J Cheminformatics 2011, 3:13.
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