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"Automated Chemical Kinetic Modeling via Hybrid Reactive Molecular Dynamics ..."
Malte Döntgen et al. (2018)
- Malte Döntgen
, Felix Schmalz
, Wassja A. Kopp, Leif C. Kröger
, Kai Leonhard
:
Automated Chemical Kinetic Modeling via Hybrid Reactive Molecular Dynamics and Quantum Chemistry Simulations. J. Chem. Inf. Model. 58(7): 1343-1355 (2018)
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