๐”– Bobbio Scriptorium
โœฆ   LIBER   โœฆ

A method for the automatic classification of chemical structures

โœ Scribed by George W. Adamson; Judith A. Bush

Publisher
Elsevier Science
Year
1973
Weight
457 KB
Volume
9
Category
Article
ISSN
0020-0271

No coin nor oath required. For personal study only.

๐Ÿ“œ SIMILAR VOLUMES

Automatic classification of chemical str
Automatic classification of chemical structure databases using a highly parallel array processor
โœ Edie M. Rasmussen; Geoffrey M. Downs; Peter Willett ๐Ÿ“‚ Article ๐Ÿ“… 1988 ๐Ÿ› John Wiley and Sons ๐ŸŒ English โš– 874 KB

This article describes the use of the ICL Distributed Array Processor (DAP) for the automatic classification of chemical structure databases using the Jarvis-Patrick clustering method. This method is based upon the calculation of a table containing the nearest neighbors for each of the molecules in

A quantum chemical method for rapid opti
A quantum chemical method for rapid optimization of protein structures
โœ Mitsuhito Wada; Minoru Sakurai ๐Ÿ“‚ Article ๐Ÿ“… 2004 ๐Ÿ› John Wiley and Sons ๐ŸŒ English โš– 170 KB

## Abstract A quantum chemical method for rapid optimization of protein structures is proposed. In this method, a protein structure is treated as an assembly of amino acid units, and the geometry optimization of each unit is performed with taking the effect of its surrounding environment into accou