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Incorporation of local structure into kriging models for the prediction of atomistic properties in the water decamer (2016)

First Author: Davie S

Attributed to: Reliable computational prediction of molecular assembly funded by EPSRC

Abstract

No abstract provided

Bibliographic Information

Digital Object Identifier: http://dx.doi.org/10.1002/jcc.24465

PubMed Identifier: 27535711

Publication URI: http://europepmc.org/abstract/MED/27535711

Type: Journal Article/Review

Parent Publication: Journal of Computational Chemistry

Issue: 27

ISSN: 0192-8651