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ALTER: eclectic management of molecular structure data
1Department of Physical and Metabolic Sciences, Astra Charnwood, Leicestershire, UK.
Journal of Molecular Graphics & Modelling
|June 1, 1997
Abstract:
ALTER is a computer program written to facilitate easy conversion between different representations of molecular structure data. The program functions as a file converter, data generation engine, and through the creation of control or input files, as an interface to other programs. The main aspects of program function--the reading and writing of files; coordinate transformation; data reorganization: structure building; data abstraction, including the generation of a wide variety of topological indices and constitutional descriptors; and display--are described in appropriate detail.