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Isotopic Effect in Double Proton Transfer Process of Porphycene Investigated by Enhanced QM/MM Method
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Isotopic Effect in Double Proton Transfer Process of Porphycene Investigated by Enhanced QM/MM Method

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Insight into the reaction mechanism of cis,cis-muconate lactonizing enzymes: a DFT QM/MM study

Tuanjai Somboon1, Matthew Paul Gleeson, Supa Hannongbua

  • 1Department of Chemistry, Faculty of Science, Kasetsart University, 50 Phaholyothin Road, Chatuchak, Bangkok 10900, Thailand.

Journal of Molecular Modeling
|May 5, 2011
PubMed

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