General effects of binding site water exclusion on hydrogen bond based molecular recognition systems : a closed binding sites is less affected by environmental changes than an open site
- Author
- ADRIAN, J. C; WILCOX, C. S
Univ. Pittsburgh, dep. chemistry, Pittsburgh PA 15260, United States - Source
Journal of the American Chemical Society. 1992, Vol 114, Num 4, pp 1398-1403 ; ref : 24 ref
- CODEN
- JACSAT
- ISSN
- 0002-7863
- Scientific domain
- Biochemistry, molecular biology, biophysics; Chemistry; Organic chemistry; Atomic molecular physics
- Publisher
- American Chemical Society, Washington, DC
- Publication country
- United States
- Document type
- Article
- Language
- English
- Keyword (fr)
- Acide carboxylique Barrière rotation Complexe moléculaire Composé organique Dynamique conformationnelle Effet solvant Enthalpie Entropie Ester Etude expérimentale Inhibiteur Liaison hydrogène Propriété thermodynamique Site actif Solution chimique Solvatation Spectre IR Spectre RMN Benzamide(2-phényl) Biphényle-2-carboxylique acide(4p-amino-6-méthyl) ester méthyle Pyrimidine(2-amino) Système hôte invité Système reconnaissance moléculaire
- Keyword (en)
- Carboxylic acid Rotation barrier Molecular complex Organic compounds Conformational dynamics Solvent effect Enthalpy Entropy Ester Experimental study Inhibitor Hydrogen bond Thermodynamic properties Active site Chemical solution Solvation Infrared spectrum NMR spectrum
- Keyword (es)
- Acido carboxílico Barrera rotación Complejo molecular Compuesto orgánico Dinámica conformacional Efecto solvente Entalpía Entropía Ester Estudio experimental Inhibidor Enlace hidrógeno Propiedad termodinámica Lugar activo Solución química Solvatación Espectro IR Espectro de RMN
- Classification
- Pascal
- 001 Exact sciences and technology / 001B Physics / 001B30 Atomic and molecular physics / 001B30C Molecular properties and interactions with photons / 001B30C15 Properties of molecules and molecular ions / 001B30C15H Barrier heights (internal rotation, inversion, rotational isomerism, conformational dynamics)
- Discipline
- Atomic and molecular physics
- Origin
- Inist-CNRS
- Database
- PASCAL
- INIST identifier
- 5427057
Sauf mention contraire ci-dessus, le contenu de cette notice bibliographique peut être utilisé dans le cadre d’une licence CC BY 4.0 Inist-CNRS / Unless otherwise stated above, the content of this bibliographic record may be used under a CC BY 4.0 licence by Inist-CNRS / A menos que se haya señalado antes, el contenido de este registro bibliográfico puede ser utilizado al amparo de una licencia CC BY 4.0 Inist-CNRS
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DOI
10.1021/ja00030a040 
https://dx.doi.org/10.1021/ja00030a040
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