Features of interactions responsible for antifungal activity against resistant type cytochrome bc1: A data-driven analysis based on the binding free energy at the atomic level
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Published in PloS one (19.11.2018)
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A computational scheme of pK a values based on the three-dimensional reference interaction site model self-consistent field theory coupled with the linear fitting correction scheme
Fujiki, Ryo, Kasai, Yukako, Seno, Yuki, Matsui, Toru, Shigeta, Yasuteru, Yoshida, Norio, Nakano, Haruyuki
Published in Physical chemistry chemical physics : PCCP (21.11.2018)
Published in Physical chemistry chemical physics : PCCP (21.11.2018)
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Journal Article
A computational scheme of p K a values based on the three-dimensional reference interaction site model self-consistent field theory coupled with the linear fitting correction scheme
Fujiki, Ryo, Kasai, Yukako, Seno, Yuki, Matsui, Toru, Shigeta, Yasuteru, Yoshida, Norio, Nakano, Haruyuki
Published in Physical chemistry chemical physics : PCCP (07.11.2018)
Published in Physical chemistry chemical physics : PCCP (07.11.2018)
Get full text
Journal Article
A computational scheme of pKa values based on the three-dimensional reference interaction site model self-consistent field theory coupled with the linear fitting correction scheme
Fujiki, Ryo, Kasai, Yukako, Seno, Yuki, Matsui, Toru, Shigeta, Yasuteru, Yoshida, Norio, Nakano, Haruyuki
Published in Physical chemistry chemical physics : PCCP (07.11.2018)
Published in Physical chemistry chemical physics : PCCP (07.11.2018)
Get full text
Journal Article
A computational scheme of pKa values based on the three-dimensional reference interaction site model self-consistent field theory coupled with the linear fitting correction schemeElectronic supplementary information (ESI) available. See DOI: 10.1039/c8cp04354j
Fujiki, Ryo, Kasai, Yukako, Seno, Yuki, Matsui, Toru, Shigeta, Yasuteru, Yoshida, Norio, Nakano, Haruyuki
Year of Publication 07.11.2018
Year of Publication 07.11.2018
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Journal Article