Molecular Docking with Open Access Software: Development of an Online Laboratory Handbook and Remote Workflow for Chemistry and Pharmacy Master’s Students to Undertake Computer-Aided Drug Design

Autor:	Alethea B. Tabor, Matthew H. Todd, Jonathan D. Wilden, H. Britton, Christopher J. Swain, Yuhang Wang, Bethanie A. Clent, Frank Otto
Rok vydání:	2021
Předmět:	Protocol (science) Computer science business.industry Software development Pharmacy General Chemistry Field (computer science) Education Engineering management Workflow Software Computer-aided business Discovery learning
Zdroj:	Journal of Chemical Education. 98:2899-2905
ISSN:	1938-1328 0021-9584
DOI:	10.1021/acs.jchemed.1c00289
Popis:	In response to the closure of many university laboratories due to the Covid-19 pandemic in 2020, a handbook and remote webinar approach designed to support students in the use of software tools for computer-aided drug design has been developed. Specifically, the course has been designed for chemistry and pharmacy students who have little or no experience of computational techniques and can use open-source software on their own machines. In this way a flexible and relevant course, giving a rigorous academic experience, could be delivered even in the most challenging of circumstances. We believe that this laboratory protocol will help to “democratize” the scientific process in this field.
Databáze:	OpenAIRE
Externí odkaz:	https://explore.openaire.eu/search/publication?articleId=doi_________::bb0f2a75904cc1374ed9550bd2ea0845 https://doi.org/10.1021/acs.jchemed.1c00289 Zobrazit plný text záznamu