Screening for Improved Nerve Agent Simulants and Insights into Organophosphate Hydrolysis Reactions from DFT and QSAR Modeling

Matthew L. Mendonca, Randall Q Snurr*

*Corresponding author for this work

Research output: Contribution to journalComment/debate

Original languageEnglish (US)
JournalChemistry - A European Journal
DOIs
StatePublished - Jan 1 2019

ASJC Scopus subject areas

  • Catalysis
  • Chemistry(all)
  • Organic Chemistry

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