Some theoretical and computational aspects of the inclusion of proton isomerism in the protonation equilibrium of proteins

Journal of Physical Chemistry B

Volumn 105, Issue 1, 2001, Pages 293-309

  Baptista, António M ^a   Scares, Cláudio M ^a  

^a INSTITUTO DE TECNOLOGIA QUÍMICA E BIOLÓGICA   (Portugal)

Author keywords

[No Author keywords available]

Indexed keywords

ALCOHOLS; COMPUTER SIMULATION; ENTROPY; MATHEMATICAL MODELS; MOLECULAR STRUCTURE; PERMITTIVITY; PH; PROTONS; WATER;

HEN EGG WHITE LYSOZYME; ISOMERISM; PROTONATION EQUILIBRIUM; TAUTOMERISM;

PROTEINS;

EID: 0035120969     PISSN: 15206106     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp002763e     Document Type: Article

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