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2 749 (0,092s) •

Project

Molecular Dynamics Simulations of Annealed Polyelectrolytes (KJB401110701)

dynamics (MD) simulations. Weak PEs have peculiar properties and many applications of weak PEs will be accounted for in an MD simulation dissociation and hence the charges on them are mobile. Current MD m...

CD - Makromolekulární chemie

  • 2007 - 2009
    • •
  • 998 tis. Kč
    • •
  • 998 tis. Kč
    • •
  • AV ČR
Project

Molecular dynamics simulations of RNA from static structures to molecular ensembles (GA23-05639S)

with experimental laboratories, with the aim to integrate MD simulations with experimental of RNA molecules and protein-RNA complexes using atomistic molecular dynamics (MD) simulations. We aim to obtain complete ...

Biophysics

  • 2023 - 2025
    • •
  • 6 892 tis. Kč
    • •
  • 6 892 tis. Kč
    • •
  • GA ČR
Project

In-silico Workflow for Lipid-Mediated Active Pharmaceutical Ingredients Delivery Systems (GA25-18467S)

by the experimental resolution, molecular dynamics (MD) simulations can be an excellent tool. The ultimate goal of the LipDel project is to derive a validated workflow for MD simulations of lipid-mediated API deli...

Physical chemistry

  • 2025 - 2027
    • •
  • 5 109 tis. Kč
    • •
  • 5 109 tis. Kč
    • •
  • GA ČR
Project

Structure and dynamics of DNA. Advanced computational studies. (GAP208/11/1822)

) calculations and explicit solvent molecular dynamics (MD) simulations. The studied issues molecules (G-DNA and i-DNA) using MD simulations and free energy computations. Complete and geometries derived by simu...

CF - Fyzikální chemie a teoretická chemie

  • 2011 - 2015
    • •
  • 4 129 tis. Kč
    • •
  • 4 129 tis. Kč
    • •
  • GA ČR
Project

Associating Amphiphilic Miktoarm and Heteroarm Polyelectrolytes (IAA401110702)

simulations) aimed at elucidation of the relationship between chain architecture, dynamics to elaborate an original combined molecular dynamics (MD) ? Monte Carlo method for simulating the behavior of annealed polyelectrol...

CF - Fyzikální chemie a teoretická chemie

  • 2007 - 2011
    • •
  • 2 530 tis. Kč
    • •
  • 2 530 tis. Kč
    • •
  • AV ČR
Project

Ab initio molecular dynamics with non-adiabatic and spin-orbit effects applied to time-dependent fluorescence (GAP208/12/0559)

The aim of this project is to develop, assess, and apply molecular dynamics (MD) methods suitable for interpretation and simulation of time-dependent fluorescence-orbit effects to MD with surface hopping or local diabatizat...

CF - Fyzikální chemie a teoretická chemie

  • 2012 - 2017
    • •
  • 8 872 tis. Kč
    • •
  • 8 872 tis. Kč
    • •
  • GA ČR
Project

Nanomechanics of RNA and DNA structural motifs (GA14-21893S)

dynamics (MD) simulation data of selected RNA and DNA molecules. We will adopt, and the atomic-resolution level. Unrestrained MD trajectories, as well as restrained simulations using umbrella sampling methodology,...

BO - Biofyzika

  • 2014 - 2016
    • •
  • 2 668 tis. Kč
    • •
  • 2 668 tis. Kč
    • •
  • GA ČR
Project

Otoacoustic emissions in normal cochlea and cochlea with endolymphatic hydrops modeling and experiments (GC23-07621J)

This international project is focused on Meniere’s disease (MD), which people. The cause of MD might be complicated, but increasing pressure in the cochlear produce disorders typical of MD. However, otoacoustic emissions (O...

Electrical and electronic engineering

  • 2023 - 2025
    • •
  • 3 622 tis. Kč
    • •
  • 3 622 tis. Kč
    • •
  • GA ČR
Project

Importance of miRNA deregulation in myelodysplastic syndromes and in other hematological clonal diseases (GP301/09/P579)

Myelodysplasic syndrome (MDS) is a family of heterogeneous blood disorders. An intensive research has been focused on MDS pathogenesis and cytogenetic aberrations associated with approx. 50% of MDS have been revealed; howev...

FD - Onkologie a hematologie

  • 2009 - 2011
    • •
  • 1 546 tis. Kč
    • •
  • 1 546 tis. Kč
    • •
  • GA ČR
Project

The molecular markers in diagnostics and therapy-monitoring of myelodysplastic syndrome patients treated by new modalities. (NV16-27790A)

Myelodysplastic syndrome (MDS) is a clonal disorder of hematopoiesis myeloid leukemia (AML). In MDS, the somatic mutations were recently found to precede MDS pathogenesis already in normal individuals. Furthermore, their ac...

FD - Onkologie a hematologie

  • 2016 - 2019
    • •
  • 12 498 tis. Kč
    • •
  • 12 498 tis. Kč
    • •
  • MZ
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