Dataset Information

Chembench: A Publicly Accessible, Integrated Cheminformatics Portal.

ABSTRACT: The enormous increase in the amount of publicly available chemical genomics data and the growing emphasis on data sharing and open science mandates that cheminformaticians also make their models publicly available for broad use by the scientific community. Chembench is one of the first publicly accessible, integrated cheminformatics Web portals. It has been extensively used by researchers from different fields for curation, visualization, analysis, and modeling of chemogenomics data. Since its launch in 2008, Chembench has been accessed more than 1 million times by more than 5000 users from a total of 98 countries. We report on the recent updates and improvements that increase the simplicity of use, computational efficiency, accuracy, and accessibility of a broad range of tools and services for computer-assisted drug design and computational toxicology available on Chembench. Chembench remains freely accessible at https://chembench.mml.unc.edu.

SUBMITTER: Capuzzi SJ

PROVIDER: S-EPMC5720369 | biostudies-literature | 2017 Feb

REPOSITORIES: biostudies-literature

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Chembench: A Publicly Accessible, Integrated Cheminformatics Portal.

Capuzzi Stephen J SJ Kim Ian Sang-June IS Lam Wai In WI Thornton Thomas E TE Muratov Eugene N EN Pozefsky Diane D Tropsha Alexander A

Journal of chemical information and modeling 20170119 2

The enormous increase in the amount of publicly available chemical genomics data and the growing emphasis on data sharing and open science mandates that cheminformaticians also make their models publicly available for broad use by the scientific community. Chembench is one of the first publicly accessible, integrated cheminformatics Web portals. It has been extensively used by researchers from different fields for curation, visualization, analysis, and modeling of chemogenomics data. Since its l ...[more]

PMID: 28045544

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Dataset Information

Chembench: A Publicly Accessible, Integrated Cheminformatics Portal.

Publications

Chembench: A Publicly Accessible, Integrated Cheminformatics Portal.

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