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  1. 1
    Predictive chemical kinetics : enabling automatic mechanism generation and evaluation
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  2. 2
    Reaction Mechanism Generator: Automatic construction of chemical kinetic mechanisms
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  3. 3
    Reaction Mechanism Generator: Automatic construction of chemical kinetic mechanisms
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  4. 4
    RPMDrate: Bimolecular chemical reaction rates from ring polymer molecular dynamics
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    Full dimensional quantum rate coefficients and kinetic isotope effects from ring polymer molecular dynamics for a seven-atom reaction OH + CH[subscript 4] → CH[subscript 3] + H[subscript 2]O
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