Molecular Dynamics Simulation of Protein Folding with Supersecondary Structure Constraints
被引:0
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作者:
Zhi Rong Sun
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机构:Tsinghua University,State Key Laboratory of Biomembrane and Membrane Engineering, Department of Biological Sciences and Biotechnology
Zhi Rong Sun
Yan Cui
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机构:Tsinghua University,State Key Laboratory of Biomembrane and Membrane Engineering, Department of Biological Sciences and Biotechnology
Yan Cui
Lun Jiang Ling
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机构:Tsinghua University,State Key Laboratory of Biomembrane and Membrane Engineering, Department of Biological Sciences and Biotechnology
Lun Jiang Ling
Qing Guo
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机构:Tsinghua University,State Key Laboratory of Biomembrane and Membrane Engineering, Department of Biological Sciences and Biotechnology
Qing Guo
Run Sheng Chen
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机构:Tsinghua University,State Key Laboratory of Biomembrane and Membrane Engineering, Department of Biological Sciences and Biotechnology
Run Sheng Chen
机构:
[1] Tsinghua University,State Key Laboratory of Biomembrane and Membrane Engineering, Department of Biological Sciences and Biotechnology
[2] Chinese Academy of Sciences,Laboratory of Protein Engineering, Institute of Biophysics
来源:
Journal of Protein Chemistry
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1998年
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17卷
关键词:
Molecular dynamics simulation;
supersecondary structure;
protein structure simulation;
D O I:
暂无
中图分类号:
学科分类号:
摘要:
We integrate molecular dynamics simulation methods with a newly developed supersecondary structure prediction method and compute the structure of a protein molecule, crambin. The computed structure is similar to the crystal structure with an rms error of 3.94 Å.
机构:
Univ Chinese Acad Sci, Sch Phys Sci, Beijing 100049, Peoples R ChinaUniv Chinese Acad Sci, Sch Phys Sci, Beijing 100049, Peoples R China
Song, Yong-Shun
Zhou, Xin
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机构:
Univ Chinese Acad Sci, Sch Phys Sci, Beijing 100049, Peoples R ChinaUniv Chinese Acad Sci, Sch Phys Sci, Beijing 100049, Peoples R China
Zhou, Xin
Zheng, Wei-Mou
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机构:
Chinese Acad Sci, Inst Theoret Phys, Key Lab Theoret Phys, Beijing 100190, Peoples R ChinaUniv Chinese Acad Sci, Sch Phys Sci, Beijing 100049, Peoples R China
Zheng, Wei-Mou
Wang, Yan-Ting
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机构:
Univ Chinese Acad Sci, Sch Phys Sci, Beijing 100049, Peoples R China
Chinese Acad Sci, Inst Theoret Phys, Key Lab Theoret Phys, Beijing 100190, Peoples R ChinaUniv Chinese Acad Sci, Sch Phys Sci, Beijing 100049, Peoples R China