Work

DR-Predictor: Incorporating Flexible Docking with Specialized Electronic Reactivity and Machine Learning Techniques to Predict CYP-Mediated Sites of Metabolism

Year: 2013

Type: article

Source: Journal of Chemical Information and Modeling

DOI: 10.1021/ci4004688

Authors: Tao-wei Huang, Jed Zaretzki, Charles Bergeron, Kristin P. Bennett, Curt M. Breneman

Institutions: Rensselaer Polytechnic Institute, Washington University in St. Louis, Albany College of Pharmacy and Health Sciences

Language: English

Topic: Computational Drug Discovery Methods

Subfield: Computational Theory and Mathematics

Field: Computer Science

Domain: Physical Sciences

Open Access status: closed

Funder: Eli Lilly and Company

OpenAlex ID: W1996242650

FWCI: 4.373

Cites: 46

Cited by: 33

Related to: 10