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  1. 1
    Molecular dynamics simulations of acids and bases in biomolecular environments

    Molecular dynamics simulations of acids and bases in biomolecular environments by Aho, Noora, kirjoittaja

    Published 2023
    Subjects:
    Linkki verkkoaineistoon
    Doctoral dissertation
  2. 2
    Exploring the mechanical properties of B2O3 glass with classical molecular dynamics simulations

    Exploring the mechanical properties of B2O3 glass with classical molecular dynamics simulations by Jääskö, Hanna

    Published 2024
    Subjects:
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    Master's thesis
  3. 3
    Atomistic simulation view on gold nanocluster functionalities via ligand shell dynamics

    Atomistic simulation view on gold nanocluster functionalities via ligand shell dynamics by Pohjolainen, Emmi, kirjoittaja

    Published 2019
    Subjects:
    JYX-julkaisuarkisto / JYX Digital Archive
    Doctoral dissertation
  4. 4
    Multiscale molecular dynamics simulations of enhanced excitation energy transport in organic microcavities

    Multiscale molecular dynamics simulations of enhanced excitation energy transport in organic microcavities by Sokolovskii, Ilia, kirjoittaja

    Published 2024
    Subjects:
    Linkki verkkoaineistoon
    Doctoral dissertation
  5. 5
    Semi-classical molecular dynamics simulations of polariton transport in organic molecules strongly coupled to Bloch Surface Waves

    Semi-classical molecular dynamics simulations of polariton transport in organic molecules strongly coupled to Bloch Surface Waves by Luo, Yunyi

    Published 2024
    Subjects:
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    Master's thesis
  6. 6
    Elucidating the ligand shell structure and dynamics of Au683MBA32 gold nanocluster using molecular dynamics simulations

    Elucidating the ligand shell structure and dynamics of Au683MBA32 gold nanocluster using molecular dynamics simulations by Lautala, Saara, kirjoittaja

    Published 2017
    Subjects:
    JYX-julkaisuarkisto / JYX Digital Archive
    Master's thesis
  7. 7
    Elucidating the ligand shell structure and dynamics of Au683MBA32 gold nanocluster using molecular dynamics simulations

    Elucidating the ligand shell structure and dynamics of Au683MBA32 gold nanocluster using molecular dynamics simulations by Lautala, Saara

    Published 2017
    Subjects:
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    Master's thesis
  8. 8
    Computational studies of catalytic active site properties and reactions at the metal–oxide interface

    Computational studies of catalytic active site properties and reactions at the metal–oxide interface by Korpelin, Ville, kirjoittaja

    Published 2022
    Subjects:
    Linkki verkkoaineistoon
    Doctoral dissertation
  9. 9
    Dynamics of the ligand-binding domains of ionotropic glutamate receptors

    Dynamics of the ligand-binding domains of ionotropic glutamate receptors by Postila, Pekka

    Published 2010
    Subjects:
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    Doctoral dissertation
  10. 10
    Dynamics of the ligand-binding domains of ionotropic glutamate receptors

    Dynamics of the ligand-binding domains of ionotropic glutamate receptors by Postila, Pekka

    Published 2010
    Subjects:
    Doctoral dissertation
  11. 11
    Exploring the chemistry of syngas on a m-ZrO2 surface with computational methods

    Exploring the chemistry of syngas on a m-ZrO2 surface with computational methods by Ikonen, Rasmus

    Published 2023
    Subjects:
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    Master's thesis
  12. 12
    Rational drug discovery : structural studies of protein-ligand complexes

    Rational drug discovery : structural studies of protein-ligand complexes by Nurminen, Elisa

    Published 2011
    Subjects:
    JYX-julkaisuarkisto / JYX Digital Archive
    Doctoral dissertation
  13. 13
    Virtual screening : development of a novel structure-based method

    Virtual screening : development of a novel structure-based method by Virtanen, Salla

    Published 2013
    Subjects:
    JYX-julkaisuarkisto / JYX Digital Archive
    Doctoral dissertation
  14. 14
    Virtual screening : development of a novel structure-based method

    Virtual screening : development of a novel structure-based method by Virtanen, Salla

    Published 2013
    Subjects:
    Yhteenveto-osa
    Doctoral dissertation
  15. 15
    Analyzing protein-nanocluster interactions with graph-based machine learning for molecular dynamics

    Analyzing protein-nanocluster interactions with graph-based machine learning for molecular dynamics by Sikoniemi, Anssi

    Published 2024
    Subjects:
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    Master's thesis
  16. 16
    Rational drug discovery : structural studies of protein-ligand complexes

    Rational drug discovery : structural studies of protein-ligand complexes by Nurminen, Elisa

    Published 2011
    Subjects:
    Doctoral dissertation
  17. 17
    SMD simulation of talin and integrin interaction : role of membrane proximal and distal integrin segments in talin binding

    SMD simulation of talin and integrin interaction : role of membrane proximal and distal integrin segments in talin binding by Palmujoki, Lassi

    Published 2022
    Subjects:
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    Master's thesis
  18. 18
    Electronic and optical properties of gold clusters with carbene ligands using density functional theory calculations

    Electronic and optical properties of gold clusters with carbene ligands using density functional theory calculations by Sabooni Asre Hazer, Maryam, kirjoittaja

    Published 2023
    Subjects:
    Linkki verkkoaineistoon
    Linkki verkkoaineistoon
    Doctoral dissertation
  19. 19
    Computational studies of biomolecular screening and interactions

    Computational studies of biomolecular screening and interactions by Niinivehmas, Sanna, kirjoittaja

    Published 2015
    Subjects:
    JYX-julkaisuarkisto / JYX Digital Archive
    Doctoral dissertation
  20. 20
    Computational studies of biomolecular screening and interactions

    Computational studies of biomolecular screening and interactions by Niinivehmas, Sanna, kirjoittaja

    Published 2015
    Subjects:
    Linkki verkkoaineistoon
    Doctoral dissertation
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