학술논문

Enabling drug discovery project decisions with integrated computational chemistry and informatics.
Document Type
Article
Source
Journal of Computer-Aided Molecular Design. Mar2017, Vol. 31 Issue 3, p287-291. 5p.
Subject
*COMPUTATIONAL chemistry
*CHEMISTRY
*COMPUTERS
*SOFTWARE engineering
*WORK environment
*CHEMINFORMATICS
Language
ISSN
0920-654X
Abstract
Computational chemistry/informatics scientists and software engineers in Genentech Small Molecule Drug Discovery collaborate with experimental scientists in a therapeutic project-centric environment. Our mission is to enable and improve pre-clinical drug discovery design and decisions. Our goal is to deliver timely data, analysis, and modeling to our therapeutic project teams using best-in-class software tools. We describe our strategy, the organization of our group, and our approaches to reach this goal. We conclude with a summary of the interdisciplinary skills required for computational scientists and recommendations for their training. [ABSTRACT FROM AUTHOR]