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Updated: Jun 7, 2025

Computation of Atmospheric Concentrations of Molecular Clusters from ab initio Thermochemistry
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Published on: April 8, 2020

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一个概率的方法在搜索空间的分子距离几何问题

Rômulo S Marques1, Michael Souza2, Fernando Batista2

  • 1Instituto de Matemática, Estatística e Computação Científica, Universidade Estadual de Campinas, Campinas 13083-859, Brazil.

Journal of chemical information and modeling
|November 13, 2024
PubMed
概括

一种新的基于频率的搜索 (FBS) 方法改善了从NMR数据中确定蛋白质结构. 这种方法利用蛋白质数据库 (PDB) 的几何信息,在解决分子距离几何问题上优于传统的深度搜索.

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