Search for dissertations about: "Mechanistic modeling"

Showing result 1 - 5 of 55 swedish dissertations containing the words Mechanistic modeling.

  2. 1. Mechanistic-Empirical Modeling of Permanent Deformation in Asphalt Concrete Layers

    University dissertation from Department of Technology and Society, Lund University

    Author : Erik Oscarsson; [2011]
    Keywords : TEKNIK OCH TEKNOLOGIER; ENGINEERING AND TECHNOLOGY; permanent deformation; modeling; Mechanistic-Empirical; rutting; asphalt concrete; full-scale pavements;

    Abstract : Popular Abstract in Swedish De allra flesta av oss bilister har någon gång kört på en väg med tydliga spår i vägytan. Man märker tydligt hur både komforten och säkerheten minskar eftersom möjligheten att styra fordonet försämras. READ MORE

  4. 2. Predictive Modeling of Lake Eutrophication

    University dissertation from Uppsala : Acta Universitatis Upsaliensis

    Author : Jan Mikael Malmaeus; Uppsala universitet.; [2004]
    Keywords : NATURVETENSKAP; NATURAL SCIENCES; Earth sciences; mass balance model; dynamic model; mechanistic model; phosphorus; LEEDS; suspended particulate matter; settling velocity; sedimentation; accumulation sediments; burial; diffusion; climate scenario; Erken; Balaton; Kinneret; Batorino; Miastro; Naroch; Galten; Ekoln; Geovetenskap; NATURAL SCIENCES Earth sciences; NATURVETENSKAP Geovetenskap;

    Abstract : This thesis presents predictive models for important variables concerning eutrophication effects in lakes. The keystone is a dynamic phosphorus model based on ordinary differential equations. READ MORE

  5. 3. Modeling and Optimization of Reversed-Phase Chromatography : Effects of Modulators and Temperature

    University dissertation from Department of Chemical Engineering, Lund University

    Author : Karolina Arkell; Lunds universitet.; Lund University.; [2017]
    Keywords : TEKNIK OCH TEKNOLOGIER; ENGINEERING AND TECHNOLOGY; Reversed-phase chromatography; Hydrophobic interaction chromatography; Mechanistic modeling; INSULIN; KCl; Ethanol; Temperature; Multi-objective optimization; Constraint; Solubility;

    Abstract : Many widespread diseases, such as diabetes, various types of cancer, and aggressive versions of influenza, are treated or prevented with biopharmaceuticals. Biopharmaceuticals are drugs that are based on proteins, peptides, antibodies, attenuated viruses (vaccines), and other biomolecules that are synthesized predominately in bacteria, yeast, and mammalian cells. READ MORE

  6. 4. Biomimetic Transition Metal Catalysts : Insights from Theoretical Modeling

    University dissertation from Stockholm : Fysikum

    Author : Adam Johannes Johansson; Stockholms universitet.; [2008]
    Keywords : NATURVETENSKAP; NATURAL SCIENCES; Catalysis; biomimetic; copper; non-heme iron; heme iron; O2 cleavage; H-atom transfer; radical chemistry; redox chemistry; thermo chemistry; entropy calculations; quantum chemistry; spin states; density functional theory DFT ; self-interaction error SIE .; NATURAL SCIENCES Physics Atomic and molecular physics Chemical physics; NATURVETENSKAP Fysik Atom- och molekylfysik Kemisk fysik; Chemical Physics; kemisk fysik;

    Abstract : The scientific interest in the chemistry of synthetic transition metal complexes is motivated by at least two arguments:1.These can be regarded as models of biological transition metal complexes, e.g. metalloenzymes, whose functions can be difficult to reveal in detail due to their complexity. READ MORE

  7. 5. Theoretical modeling of metal- and enzyme catalyzed transformations

    University dissertation from Stockholm : Department of Organic Chemistry, Stockholm University

    Author : Jonas Nyhlén; Stockholms universitet.; [2010]
    Keywords : NATURVETENSKAP; NATURAL SCIENCES; density functinal theory; computational chemistry; directed evolution; enzyme; mechanistic studies; catalysis; ruthenium; hydrogen transfer; racemization; artificial photosynthesis; frustrated lewis pairs; hydrogen storage; NATURAL SCIENCES Chemistry Organic chemistry; NATURVETENSKAP Kemi Organisk kemi; organisk kemi; Organic Chemistry;

    Abstract : This thesis is focused on describing and predicting catalytic reactions. The major part of the work is based on density functional theory (DFT). In some cases where the size of the investigated system precluded the use of more accurate methods molecular dynamics was employed. READ MORE