Ligand Strain and Entropic Effects on the Binding of Macrocyclic and Linear Inhibitors: Molecular Modeling of Penicillopepsin Complexes

dc.contributor.author	Suárez Rodríguez, Dimas
dc.contributor.author	Díaz Fernández, Natalia
dc.date.accessioned	2018-02-06T10:11:23Z
dc.date.available	2018-02-06T10:11:23Z
dc.date.issued	2017
dc.identifier.citation	Journal of Chemical Information and Modeling, 57(8), p. 2045-2055 (2017); doi:10.1021/acs.jcim.7b00355
dc.identifier.issn	1549-9596
dc.identifier.uri	http://hdl.handle.net/10651/45511
dc.description.sponsorship	This research was supported by the GRUPIN14-049 (FICyT, Spain) grant.
dc.format.extent	p. 2045-2055
dc.language.iso	eng
dc.relation.ispartof	Journal of Chemical Information and Modeling
dc.rights	© 2017 American Chemical Society
dc.source	Scopus
dc.source.uri	https://www.scopus.com/inward/record.uri?eid=2-s2.0-85028570699&doi=10.1021%2facs.jcim.7b00355&partnerID=40&md5=e67d8e05cc72a2e6202bc2a0a7d1ab8f
dc.title	Ligand Strain and Entropic Effects on the Binding of Macrocyclic and Linear Inhibitors: Molecular Modeling of Penicillopepsin Complexes
dc.type	journal article
dc.identifier.doi	10.1021/acs.jcim.7b00355
dc.relation.projectID	FICYT/GRUPIN14-049
dc.relation.publisherversion	http://dx.doi.org/10.1021/acs.jcim.7b00355

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