New hydrogen-bond potentials for use in determining energetically favorable binding sites on molecules of known structure
- Author
- BOOBBYER, D. N. A; GOODFORD, P. J; MCWHINNIE, P. M; WADE, R. C
Univ. Oxford, lab. molecular biophysics, Oxford OX1 3QU, United Kingdom - Source
Journal of medicinal chemistry (Print). 1989, Vol 32, Num 5, pp 1083-1094, 12 p ; ref : 75 ref
- CODEN
- JMCMAR
- ISSN
- 0022-2623
- Scientific domain
- Pharmacology drugs
- Publisher
- American Chemical Society, Washington, DC
- Publication country
- United States
- Document type
- Article
- Language
- English
- Keyword (fr)
- Composé biologique Energie liaison Etude théorique Interaction électrostatique Liaison hydrogène Modèle Lennard Jones Site fixation
- Keyword (en)
- Biological compound Binding energy Theoretical study Electrostatic interaction Hydrogen bond Lennard Jones model Binding site
- Keyword (es)
- Compuesto biológico Energía enlace Estudio teórico Interacción electrostática Enlace hidrógeno Modelo Lennard Jones Sitio fijación
- Classification
- Pascal
- 002 Biological and medical sciences / 002A Fundamental and applied biological sciences. Psychology / 002A03 Molecular biophysics / 002A03H Intermolecular phenomena / 002A03H01 Interactions. Associations
- Discipline
- Molecular biophysics
- Origin
- Inist-CNRS
- Database
- PASCAL
- INIST identifier
- 19706641
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/jm00125a025 
https://dx.doi.org/10.1021/jm00125a025
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