Sökning: "QM"

Visar resultat 1 - 5 av 37 avhandlingar innehållade ordet QM.

  1. 1. QM/MM free-energy perturbation and other methods to estimate ligand-binding affinities

    Detta är en avhandling från Lund University, Faculty of Science, Department of Chemistry, Division of Theoretical Chemistry

    Författare :Martin Olsson; Lund University.; Lunds universitet.; [2018-02]
    Nyckelord :NATURVETENSKAP; NATURAL SCIENCES; Computer-aided drug design; protein–ligand binding; molecular dynamics; free-energy perturbation; QM MM; convergence;

    Sammanfattning : Experimental drug discovery is very time-consuming, risky and comes at a huge cost, typically several billion USD per drug. Even though decades of experimental drug discovery have provided cures of many diseases, there are still diseases for which there is no effective drug available. LÄS MER

  2. 2. Reaction mechanism of metalloenzymes studied by theoretical methods

    Detta är en avhandling från Lund University, Faculty of Science, Department of Chemistry, Division of Theoretical Chemistry

    Författare :Geng Dong; Lund University.; Lunds universitet.; [2018-05]
    Nyckelord :NATURVETENSKAP; NATURAL SCIENCES; Metalloenzymes; Reaction mechanism; QM MM; DFT; DMRG; CAS-srDFT; Big-QM; QTCP;

    Sammanfattning : Metalloenzymes catalyse a wide variety of reactions in nature. In the thesis, I have studied the reaction mechanism of three metalloenzymes, viz. LÄS MER

  3. 3. Text Mining The Quality Paradigm(s)

    Detta är en avhandling från Sundsvall : Mid Sweden University

    Författare :Daniel Carnerud; Mittuniversitetet.; [2019]
    Nyckelord :TEKNIK OCH TEKNOLOGIER; ENGINEERING AND TECHNOLOGY; Quality Paradigm; Quality Movement; Quality Revolution; Quality Management; QM; Total Quality Management; TQM; Business Excellence; Text Mining; Data Mining; Kvalitetsparadigm; Kvalitetsrörelsen; Kvalitetsteknik; Offensiv Kvalitetsutveckling; Text Mining; Data Mining;

    Sammanfattning : The purpose of this thesis orbits around an examination of the formation of a quality paradigm. In this inquiry, the exploration and application of text mining have been used to provide new insights into quality as a paradigm. LÄS MER

  4. 4. Cellulases from Trichoderma reesei QM 9414 : enzymatic and structural properties

    Detta är en avhandling från Uppsala : Acta Universitatis Upsaliensis

    Författare :Lars G. Fägerstam; Uppsala universitet.; [1981]
    Nyckelord :NATURVETENSKAP; NATURAL SCIENCES; NATURAL SCIENCES; NATURVETENSKAP;

    Sammanfattning : .... LÄS MER

  5. 5. Cellulases from Trichoderma viride QM 9414

    Detta är en avhandling från Uppsala : Acta Universitatis Upsaliensis

    Författare :Ulf Håkansson; Uppsala universitet.; [1979]
    Nyckelord :NATURVETENSKAP; NATURAL SCIENCES; NATURAL SCIENCES; NATURVETENSKAP;

    Sammanfattning : .... LÄS MER