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Publication details

Document type
Journal articles

Document subtype
Full paper

Title
Tackling Halogenated Species with PBSA: Effect of Emulating the ?-Hole

Participants in the publication
Rafael Nunes (Author)
Dep. Química e Bioquímica
BioISI
CQB
Diogo Vila-Viçosa (Author)
Dep. Química e Bioquímica
CQB
BioISI
Paulo J. Costa (Author)
Dep. Química e Bioquímica
Dep. Química e Bioquímica
BioISI

Date of Publication
2019-05-29

Where published
Journal of Chemical Theory and Computation

Publication Identifiers
ISSN - 1549-9618
eISSN - 1549-9626

Publisher
American Chemical Society (ACS)

Volume
15
Number
7

Number of pages
10
Starting page
4241
Last page
4251

Document Identifiers
DOI - https://doi.org/10.1021/acs.jctc.9b00106
URL - http://dx.doi.org/10.1021/acs.jctc.9b00106


Export

APA
Rafael Nunes, Diogo Vila-Viçosa, Paulo J. Costa, (2019). Tackling Halogenated Species with PBSA: Effect of Emulating the ?-Hole. Journal of Chemical Theory and Computation, 15, 4241-4251. ISSN 1549-9618. eISSN 1549-9626. http://dx.doi.org/10.1021/acs.jctc.9b00106

IEEE
Rafael Nunes, Diogo Vila-Viçosa, Paulo J. Costa, "Tackling Halogenated Species with PBSA: Effect of Emulating the ?-Hole" in Journal of Chemical Theory and Computation, vol. 15, pp. 4241-4251, 2019. 10.1021/acs.jctc.9b00106

BIBTEX
@article{39233, author = {Rafael Nunes and Diogo Vila-Viçosa and Paulo J. Costa}, title = {Tackling Halogenated Species with PBSA: Effect of Emulating the ?-Hole}, journal = {Journal of Chemical Theory and Computation}, year = 2019, pages = {4241-4251}, volume = 15 }