All Stories

  1. Transferability evaluation of the deep potential model for simulating water-graphene confined system
  2. The mechanism for the complexation and dissociation between siRNA and PMAL: a molecular dynamics simulation study based on a coarse-grained model
  3. Uniform mPEG-b-PMETAC enables pH-responsive delivery of insulin
  4. Kinetic and multidimensional profiling of accelerated degradation of oil sludge by biostimulation
  5. How ABA block polymers activate cytochrome c in toluene: molecular dynamics simulation and experimental observation
  6. A molecular theory for optimal blue energy extraction by electrical double layer expansion
  7. Ecological and enzymatic responses to petroleum contamination
  8. Surface tension effects on the phase transition of a DPPC bilayer with and without protein: a molecular dynamics simulation
  9. Electrokinetic desalination using honeycomb carbon nanotubes (HC-CNTs): a conceptual study by molecular simulation
  10. Multiscale simulation of surfactant–aquaporin complex formation and water permeability