Development of Accurate Force Fields for Mg2+ and Triphosphate Interactions in ATP·Mg2+ and GTP·Mg2+ Complexes

Fangchen Hu, Yuwei Zhang, Pengfei Li, Ruibo Wu, Fei Xia

Research output: Contribution to journalArticlepeer-review

Original languageEnglish
Pages (from-to)10553-10563
Number of pages11
JournalJournal of Chemical Theory and Computation
Volume20
Issue number23
DOIs
StatePublished - Dec 10 2024
Externally publishedYes

ASJC Scopus Subject Areas

  • Computer Science Applications
  • Physical and Theoretical Chemistry

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