International Tables for Crystallography


Molecular surfaces: calculations, uses and representations
M. S. Chapman and M. L. Connolly. International Tables for Crystallography (2012). Vol. F, ch. 22.2, pp. 713-720  [ doi:10.1107/97809553602060000886 ]

Abstract

In this chapter, the calculation of molecular surface areas, the uses of surface-area calculations and the representation of molecular surfaces are discussed.


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About International Tables for Crystallography

International Tables for Crystallography is the definitive resource and reference work for crystallography. The multi-volume series comprises articles and tables of data relevant to crystallographic research and to applications of crystallographic methods in all sciences concerned with the structure and properties of materials.