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Energy-based de novo protein folding by conformational space annealing and an off-lattice united-residue force field: Application to the 10-55 fragment of staphylococcal protein A and to apo calbindin D9K

The conformational space annealing (CSA) method for global optimization has been applied to the 10-55 fragment of the B-domain of staphylococcal protein A (protein A) and to a 75-residue protein, apo calbindin D9K (PDB ID code 1CLB), by using the UNRES off-lattice united-residue force field. Althoug...

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Veröffentlicht in:Proc Natl Acad Sci U S A
Hauptverfasser: Lee, Jooyoung, Liwo, Adam, Scheraga, Harold A.
Format: Artigo
Sprache:Inglês
Veröffentlicht: National Academy of Sciences 1999
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Online-Zugang:https://ncbi.nlm.nih.govhttps://pmc.ncbi.nlm.nih.gov/articles/PMC26730/
https://ncbi.nlm.nih.govhttps://pubmed.ncbi.nlm.nih.gov/10051588/
https://ncbi.nlm.nih.govhttps://doi.org/10.1073/pnas.96.5.2025
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