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A fast system for the best matching of two sets of atomic coordinates

โœ Scribed by Zong Jie Liu; Roland Van Rapenbusch


Book ID
103506850
Publisher
Elsevier Science
Year
1989
Tongue
English
Weight
835 KB
Volume
13
Category
Article
ISSN
0097-8485

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A fast, direct algorithm for the least-s
โœ Zong Jie Liu; Roland Van Rapenbusch ๐Ÿ“‚ Article ๐Ÿ“… 1988 ๐Ÿ› John Wiley and Sons ๐ŸŒ English โš– 337 KB ๐Ÿ‘ 2 views

By use of rotation angle method a direct algorithm is derived, which determines the least-squares superposition that matches two sets of atomic coordinates. The program based on this algorithm runs fast. The solution obtained by this algorithm cannot be trapped by any local minimum. Testing examples