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10.1021/acs.accounts.6b00555

http://scihub22266oqcxt.onion/10.1021/acs.accounts.6b00555
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C5849427!5849427!28945421
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suck abstract from ncbi

pmid28945421      Acc+Chem+Res 2017 ; 50 (3): 561-6
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  • Catalysts by Design: The Power of Theory #MMPMID28945421
  • Hammes-Schiffer S
  • Acc Chem Res 2017[Mar]; 50 (3): 561-6 PMID28945421show ga
  • Theoretical design of effective catalysts, in conjunction with the identification of guiding design principles and strategies, is a Holy Grail in Chemistry. Although further progress will benefit from additional computational advances, theoretical studies have already enhanced the design of molecular electrocatalysts, photocatalysts, and enzymes.
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