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A ComputationalTool for Structural Biology: Crystallographic Refinement by Simulated Annealing
Brünger, Axel T.
Brünger, Axel T.
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Issue Date
1988
Submitted date
2023-11-03
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Adobe PDF, 1.81 MB
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Abstract
Conventional refinementof biological macromolecules involvesa series of steps, each of which consists ofa few cyclesofrestrained least-squares refinement with stereochemical and internal packingconstraints orrestraints that are followed by rebuilding the modelstructure with interactive computer graphics. Duringthefinal stages of refinement solvent molecules are usually included and alternative conformations for some atomsor residues in the protein may be introduced.
Citation
Advances in protein design, 35 - 37
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Book chapter
conference paper
conference paper
Language
en
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Series/Report no.
GBF monographs ; Volume 12
ISSN
0930-4320
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ISBN
3527280243
0895739534
0895739534
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Attribution-NonCommercial-ShareAlike 4.0 International