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rPM6 Parameters for Manganese and Application to Transition State Search for Oxidation Reactions of Cyclohexene by Manganese(IV)-Oxo Species
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rPM6 Parameters for Manganese and Application to Transition State Search for Oxidation Reactions of Cyclohexene by Manganese(IV)-Oxo Species

Saito, Toru ; Takano, Yu

Chemistry letters, 2017-10, Vol.46 (10), p.1567-1569 [Periódico revisado por pares]

Tokyo: The Chemical Society of Japan

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Theoretical Study on the Regulating Mechanism of the Transition Between the Open-closed State of hCtBP2: A Combined Molecular Dynamics and Quantum Mechanical Interaction Analysis
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Theoretical Study on the Regulating Mechanism of the Transition Between the Open-closed State of hCtBP2: A Combined Molecular Dynamics and Quantum Mechanical Interaction Analysis

Yamamoto, Yuta ; Shigeta, Yasuteru

Chemistry letters, 2023-02, Vol.52 (2), p.120-123 [Periódico revisado por pares]

Tokyo: The Chemical Society of Japan

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