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نمایش تعداد 61-160 از 28

      • elemental semiconductors (1)
      ensemble Monte Carlo simulation (1)
      Enzyme-substrate interaction (2)
      FEL analysis (1)
      Flavonol (1)
      Fluctuations (1)
      force field (1)
      Fowler’s approximation (1)
      full-scale whole device EMC-MD simulation (1)
      G (1)
      G-quadruplex (1)
      Gas diffusion (1)
      gate electrode (1)
      gate-all-around nanowire silicon MOSFET (1)
      geometrical parameters (1)
      geometry (1)
      Glucose oxidase (2)
      gold (1)
      gold nanoparticle coating (1)
      GPU-enabled molecular dynamics simulations (1)
      Graphene oxide nanosheet (1)
      graphic processing unit (1)
      graphics processing unit (1)
      graphics processing units (2)
      hardware failure (1)
      Heteropoly acids (HPAs) (1)
      HFD-like fluids (1)
      Hydrogen bond (1)
      Inactivation (2)
      inhibition (1)
      insulin coating (1)
      Ion diffusion (1)
      Ionic Conductivity (1)
      Ionic liquid (1)
      LAMMPS (1)
      large scale atomic-molecular massively parallel simulator (1)
      LiCoO2 cathode material (1)
      ligand-recepto (1)
      lipid bilayers (1)
      lipid membranes (1)
      Lipid Substitutions (1)
      Lithium ion battery (1)
      magnetic field effects (1)
      magnetic particles (1)
      maximum utilization model (1)
      MD simulation (18)
      MD simulations (2)
      Membrane (1)
      membrane electric field (1)
      Methane adsorption (1)
      MM-PBSA (1)
      molecular biophysics (3)
      Molecular Dynamics (MD) Simulation (1)
      molecular dynamics (MD) simulation (1)
      molecular dynamics method (3)
      molecular dynamics simulation (1)
      molecular dynamics simulations (1)
      Monte Carlo methods (1)
      MOSFET (1)
      n complex workflow management (1)
      n DCI resources manager (1)
      n gUSE technologies (1)
      n heterogeneous distributed computing infrastructures (1)
      n Image color analysis (1)
      n IMP science gateway portal (1)
      n MD simulations (1)
      n molecular dynamics simulations (1)
      n physics computing (1)
      n portals (1)
      n SG ideology (1)
      n software components (1)
      n user interfaces (1)
      n user-friendly intuitive interface (1)
      n virtual experimental labs (1)
      n workflow management software (1)
      n WS-PGRADE (1)
      nanomagnetics (1)
      nanomedicine (1)
      nanoparticles (1)
      Nanotube (1)
      nanowires (1)
      Neomycin B (1)
      nondedicated high-end clusters (1)
      OH radicals (1)
      oxidative species (1)
      Penetration, Carbone Nanotube, Lipid bilayer, MD simulation (1)
      plasma device design (1)
      plasma-membra (1)
      proteins (1)
      Proton transport mechanisms (1)
      QM investigation (2)
      Quantum Mechanical Investigation (1)
      Quercetin (1)
      random dopant distribution (1)
      RDF (1)
      ReaxFF subroutine (1)
      resource allocation (1)
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      resource utilization (1)
      RNA aptasensor · Neomycin B · MD simulation · Theoretical design · Electrostatic interaction (1)