[Chimera-users] PubChem Online Compound Search and Download

Aldo Segura aldosegura at gmail.com
Fri May 25 18:24:43 PDT 2012

Dear Nancy,

I don't know how Pubchem works but I think that you should try to use
ZINC database (zinc.docking.org) which has implemented a large number
of filters (pH, toxic functional groups, etc) and the selected
compounds can be downloaded as a compound library.

Best regards,

Aldo Segura-Cabrera
Laboratorio de Bioinformática
Centro de Biotecnología Genómica
Instituto Politécnico Nacional
Blvd. Del Maestro esquina Elías Piña, 88710
Reynosa, Tamaulipas, México.
(899)9243627 ext. 87729
e-mail: asegurac at ipn.mx; aldosegura at gmail.com

More information about the Chimera-users mailing list