Determination of an empirical energy function for protein conformational analysis by energy embedding

It is quite easy to propose an empirical potential for conformational analysis such that given crystal structures lie near local minima. What is much more difficult, is to devise a function such that the native structure lies near a relatively deep local minimum, at least in some neighborhood of the...

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Veröffentlicht in:	Journal of computational chemistry 1987-10, Vol.8 (7), p.972-981
Hauptverfasser:	Crippen, Gordon M., Ponnuswamy, P. K.
Format:	Artikel
Sprache:	eng
Schlagworte:	Biological and medical sciences Fundamental and applied biological sciences. Psychology Molecular biophysics Structure in molecular biology Tridimensional structure
Online-Zugang:	Volltext
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