An improved methodology to compute surface site interaction points using high density molecular electrostatic potential surfaces

dc.contributor.author	Oliver, A.
dc.contributor.author	Hunter, C.A.
dc.contributor.author	Prohens, R.
dc.contributor.author	Rosselló, J.L.
dc.date.accessioned	2024-02-09T08:42:53Z
dc.date.available	2024-02-09T08:42:53Z
dc.identifier.uri	http://hdl.handle.net/11201/164666
dc.description.abstract	-
dc.format	application/pdf
dc.relation.isformatof	https://doi.org/10.1002/jcc.25574
dc.relation.ispartof	Journal of Computational Chemistry, 2018, vol. 39, num. 28, p. 2371-2377
dc.rights	, 2018
dc.subject.classification	62 - Enginyeria. Tecnologia
dc.subject.classification	53 - Física
dc.subject.other	62 - Engineering. Technology in general
dc.subject.other	53 - Physics
dc.title	An improved methodology to compute surface site interaction points using high density molecular electrostatic potential surfaces
dc.type	info:eu-repo/semantics/article
dc.date.updated	2024-02-09T08:42:53Z
dc.subject.keywords	DFT
dc.rights.accessRights	info:eu-repo/semantics/openAccess
dc.identifier.doi	https://doi.org/10.1002/jcc.25574