Computational Chemistry on a Budget: Supporting Drug Discovery with Limited Resources

Autor:	Henriette Willems, Stephane De Cesco, Fredrik Svensson, Sue Dale Tunnicliffe
Rok vydání:	2020
Předmět:	010404 medicinal & biomolecular chemistry 0303 health sciences 03 medical and health sciences Chemistry Drug discovery Best practice Drug Discovery Molecular Medicine 01 natural sciences Data science Limited resources 030304 developmental biology 0104 chemical sciences
Zdroj:	Journal of Medicinal Chemistry. 63:10158-10169
ISSN:	1520-4804 0022-2623
DOI:	10.1021/acs.jmedchem.9b02126
Popis:	An increasing number of new drugs have their origin in small biotech or academia. In contrast to big pharma, these environments are often more limited in terms of resources, and this necessitates different approaches to the drug discovery process. In this review, we outline how computational methods can help advance drug discovery in a setting with more limited resources and we share what, based on our experience, are the best practices for these methods.
Databáze:	OpenAIRE
Externí odkaz:	https://explore.openaire.eu/search/publication?articleId=doi_________::5c56ccfaf616f2907928276e3d568f35 https://doi.org/10.1021/acs.jmedchem.9b02126