Volume 2 Chapter 3 3D-Constrain Sub-menu ATOM-RADIUS

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*CREMER

Function

*CREMER is used to define the puckering parameters of n-membered rings (n>3) in terms of the (n-3) amplitudes and phase angles of pseudorotation, as described by Cremer and Pople, J.Amer.Chem.Soc. 97, 1354-1358 (1975).

Example

Related Command

DEFINE *ALSUN

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Volume 2 Chapter 3 3D-Constrain Sub-menu *LP2.