ERIC Number: EJ1215736
Record Type: Journal
Publication Date: 2019-May
Pages: 6
Abstractor: As Provided
ISBN: N/A
ISSN: ISSN-0021-9584
EISSN: N/A
Computer-Aided Drug Design for Undergraduates
Tantillo, Dean J.; Siegel, Justin B.; Saunders, Carla M.; Palazzo, Teresa A.; Painter, Phillip P.; O'Brien, Terrence E.; Nuñez, Nicole N.; Nouri, Dustin H.; Lodewyk, Michael W.; Hudson, Brandi M.; Hare, Stephanie R.; Davis, Rebecca L.
Journal of Chemical Education, v96 n5 p920-925 May 2019
A series of computational laboratory experiments aimed at teaching students principles of rational drug design are described and evaluated. These experiments range from an introduction to viewing protein-ligand complexes to optimizing geometries of potential drugs with quantum chemistry and automated docking. Student feedback indicates that such a course increased their appreciation for the roles of chemists in the drug discovery-development process.
Descriptors: Undergraduate Students, Laboratory Experiments, Chemistry, College Science, Science Instruction, Science Experiments, Drug Therapy, Computer Assisted Design, Computation
Division of Chemical Education, Inc. and ACS Publications Division of the American Chemical Society. 1155 Sixteenth Street NW, Washington, DC 20036. Tel: 800-227-5558; Tel: 202-872-4600; e-mail: eic@jce.acs.org; Web site: http://pubs.acs.org/jchemeduc
Publication Type: Journal Articles; Reports - Descriptive
Education Level: Higher Education; Postsecondary Education
Audience: N/A
Language: English
Sponsor: N/A
Authoring Institution: N/A
Grant or Contract Numbers: N/A