Developing a user-friendly code for the fast estimation of well-behaved real-space partial charges

dc.contributor.author	Gallegos González, Miguel
dc.contributor.author	Martín Pendás, Ángel
dc.date.accessioned	2023-10-25T08:55:35Z
dc.date.available	2023-10-25T08:55:35Z
dc.date.issued	2023
dc.identifier.citation	Journal of Chemical Information and Modeling, 63(13), p. 4100-4114 (2023); doi:10.1021/acs.jcim.3c00597
dc.identifier.issn	1549-9596
dc.identifier.uri	https://hdl.handle.net/10651/70020
dc.description.sponsorship	The authors kindly acknowledge the Spanish MICIU, project PID2021-122763NB-I00,for financial support. M.G. specifially acknowledges the Spanish MICIU for a predoctoral grant (FPU19/02903).
dc.format.extent	p. 4100-4114
dc.language.iso	eng
dc.relation.ispartof	Journal of Chemical Information and Modeling
dc.rights	© 2023 The Authors.
dc.rights	CC Reconocimiento 4.0 Internacional
dc.rights.uri	http://creativecommons.org/licenses/by/4.0/
dc.source	Scopus
dc.source.uri	https://www.scopus.com/inward/record.uri?eid=2-s2.0-85164261111&doi=10.1021%2facs.jcim.3c00597&partnerID=40&md5=3ab52d2ba772fad7999f16e3e8389e53
dc.title	Developing a user-friendly code for the fast estimation of well-behaved real-space partial charges
dc.type	journal article
dc.identifier.doi	10.1021/acs.jcim.3c00597
dc.relation.projectID	PID2021-122763NB-I00
dc.relation.projectID	FPU19/02903
dc.relation.publisherversion	http://dx.doi.org/10.1021/acs.jcim.3c00597
dc.rights.accessRights	open access
dc.type.hasVersion	VoR

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