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Updated: Jun 27, 2025

Protein WISDOM: A Workbench for In silico De novo Design of BioMolecules
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关于基于结构标准的蛋白质力场的验证

Martin Stroet1, Martina Setz2, Thomas Lee1

  • 1The University of Queensland, St. Lucia, Queensland 4072, Australia.

The journal of physical chemistry. B
|May 7, 2024
PubMed
概括

评估蛋白质力场需要全面的验证. 这项研究显示了GROMOS力场集之间的小差异,一个指标的改善往往被另一个指标的下降所抵消,警告不要采用有限的验证方法.

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