Explore

usenet news poster usenet at nlm.nih.gov
Thu Sep 27 08:17:30 EST 1990


In article <3137 at bruce.cs.monash.OZ.AU> lloyd at bruce.cs.monash.OZ.AU (lloyd allison) writes:
>This is to request references to a package called Explore (sp?)
>that predicts protein tertiary structure.
>
>Lloyd Allison 		
>Department of Computer Science	UUCP:	lloyd at bruce.cs.monash.edu.au
>Monash University, Clayton	or  :   uunet!munnari!bruce.cs.monash.edu!lloyd
>VICTORIA 3168, AUSTRALIA        Tel :   565-5205            FAX: +61 3 565 5146

EXPLOR is a Polygen product based on work by Axel Brunger and Martin Karplus
using molecular dynamics and simulated annealing to refine three dimensional
X-ray crystal structures.

See:

Brunger AT; Clore GM; Gronenborn AM; Karplus M
Proc Natl Acad Sci U S A 83: 3801-5 (1986)
Three-dimensional structure of proteins determined by molecular
    dynamics with interproton distance restraints: application to crambin.

and many subsequent references.

David States					states at ncbi.nlm.nih.gov
National Center for Biotechnology Information
National Library of Medicine




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