Prediction of organic homolytic bond dissociation enthalpies at near chemical accuracy with sub-second computational cost 论文

2020Nature Communications引用 334顶会
DOIPDF
Chemical Thermodynamics and Molecular StructureComputational Drug Discovery MethodsFree Radicals and Antioxidants
Computational Drug Discovery MethodsFree Radicals and AntioxidantsChemical Thermodynamics and Molecular Structure
相关技术:Computational Drug Discovery Methods
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Prediction of organic homolytic bond dissociation enthalpies at near chemical accuracy with sub-second computational cost · 作者

R

Robert S. Paton

S

Seonah Kim

Y

Yeonjoon Kim

Y

Yanfei Guan

P

Peter C. St. John