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PubChem Announcements


October 30, 2009
PubChem Entrez displays now include a "Selected Records" panel to help users discover informative annotations and subsets among search results. For example, following a keyword search of PubChem Compound for "aspirin", the "Selected Compounds" panel includes a line saying "Protein 3D Structures, Compound Count: 4." This indicates that 4 of the 85 compound records retrieved by the "aspirin" search were derived from Protein 3D structures. Clicking on "4" shows which 4 out of the 85 compounds were observed binding to proteins. Clicking on "Protein 3D Structures" shows the 20 experimental protein 3D structures observed to bind these compounds.

Structures from the Ganolix are now available in PubChem.


September 30, 2009


September 17, 2009


September 2, 2009


August 4, 2009
Structures from Tyger Scientific are now available in PubChem.

Structures from PennChem-GAM are now available in PubChem.


June 30, 2009
Structures from IS Chemical Technology are now available in PubChem.


June 12, 2009
Protein-ligand binding affinity data from the PDBbind database have now been deposited into PubChem BioAssay database by the Shanghai Institute of Organic Chemistry.



June 9, 2009
Structures from ZINC are updated in PubChem.


June 4, 2009
Structures from Vitas-M Laboratory are now available in PubChem.


May 21, 2009
Structures from Shanghai Sinofluoro Scientific Company are now available in PubChem.

Structures from Alinda Chemical are now available in PubChem.


April 24, 2009


April 2, 2009
Structures from novo|seek are now available in PubChem. Novo|seek is a search engine for biomedical literature in Medline and US Grants.


March 30, 2009

Small molecule screening data from Broad Institute are now available in PubChem.





February 25, 2009
Structures from Nature Chemistry are now available in PubChem.


February 13, 2009


February 3, 2009
PubChem3D is released consisting of a single theoretical 3D conformer per compound record and includes a new similarity relationship (Similar Conformers).

XLogP is now updated to version 3.0 of the algorithm.  InChI and InChIKey are now updated to use the version 1.0.2 standard.


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