"Beyond the Ground State: Predicting Electron Ionization Mass Spectra Using ..."

Shunyang Wang et al. (2022)

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DOI: 10.1021/ACS.JCIM.2C00597

access: closed

type: Journal Article

metadata version: 2023-09-30

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Shunyang Wang, Tobias Kind, Parker Ladd Bremer, Dean J. Tantillo, Oliver Fiehn:
Beyond the Ground State: Predicting Electron Ionization Mass Spectra Using Excited-State Molecular Dynamics. J. Chem. Inf. Model. 62(18): 4403-4410 (2022)

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