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 series consists of eight volumes and 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.