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Journal Abstract Search


3956 related items for PubMed ID: 21920322

  • 1. Hybrid schemes based on quantum mechanics/molecular mechanics simulations goals to success, problems, and perspectives.
    Ferrer S, Ruiz-Pernía J, Martí S, Moliner V, Tuñón I, Bertrán J, Andrés J.
    Adv Protein Chem Struct Biol; 2011; 85():81-142. PubMed ID: 21920322
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  • 5. Combined quantum mechanics/molecular mechanics (QM/MM) methods in computational enzymology.
    van der Kamp MW, Mulholland AJ.
    Biochemistry; 2013 Apr 23; 52(16):2708-28. PubMed ID: 23557014
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  • 8. Computational enzymology: insight into biological catalysts from modelling.
    van der Kamp MW, Mulholland AJ.
    Nat Prod Rep; 2008 Dec 23; 25(6):1001-14. PubMed ID: 19030602
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  • 9. Computational enzyme design: transitioning from catalytic proteins to enzymes.
    Mak WS, Siegel JB.
    Curr Opin Struct Biol; 2014 Aug 23; 27():87-94. PubMed ID: 25005925
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  • 13. The increasing role of QM/MM in drug discovery.
    Lodola A, De Vivo M.
    Adv Protein Chem Struct Biol; 2012 Aug 23; 87():337-62. PubMed ID: 22607760
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  • 14. Recent advances in engineering proteins for biocatalysis.
    Li Y, Cirino PC.
    Biotechnol Bioeng; 2014 Jul 23; 111(7):1273-87. PubMed ID: 24802032
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  • 19. Role of substrate dynamics in protein prenylation reactions.
    Chakravorty DK, Merz KM.
    Acc Chem Res; 2015 Feb 17; 48(2):439-48. PubMed ID: 25539152
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