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Rapid comparison of protein structures (1982)

McLachlan, A. D.

[S.l.] : International Union of Crystallography (IUCr)

Acta crystallographica 38 (1982), S. 871-873

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ISSN: 1600-5724

Source: Crystallography Journals Online : IUCR Backfile Archive 1948-2001

Topics: Chemistry and Pharmacology , Geosciences , Physics

Notes: An unusually fast method of superposing two sets of atomic coordinates for related molecular structures by least squares is described. It exploits the special nature of the problem and uses the method of conjugate gradients. The calculation takes about 0.003 s and is fast enough to be used in on-line graphics systems.

Type of Medium: Electronic Resource

URL: http://dx.doi.org/10.1107/S0567739482001806

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