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RM1 Semiempirical Molecular Orbital Model

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    • Isotope effect
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    • Lanthanides
    • Liquid Crystals
    • Luminescence
    • Metabolomics
    • Natural products
    • NMR
    • Nanotechnology
    • Nonlinear optics
    • Optics
    • Photochemistry
    • pKa
    • Polarized MO
    • Polymers
    • Proteins
    • Proton transfer
    • QM/MM
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    • Solvation
    • Superdelocalizability
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Research topics

 

References and excerpts from papers reporting research using RM1.

  • QSPR/QSAR
  • ADME-Tox
  • Barrier height
  • Binding Affinities
  • Calixarene
  • Cavitand
  • CI
  • Charges
  • Chemical Reactions
  • Corrosion Inhibition
  • Dispersion
  • DNA/RNA
  • Docking
  • Drug design
  • Electrochemistry
  • Electron affinity
  • Electrostatic Potential
  • Enthalpies
  • Explosives
  • Geometry
  • Hydrogen bond RM1_BH
  • Inclusion Compounds
  • Ionic Liquids
  • Isotope effect
  • Langmuir
  • Lanthanide Complexes
  • Lanthanides
  • Liquid Crystals
  • Luminescence
  • Metabolomics
  • Natural products
  • NMR
  • Nanotechnology
  • Nonlinear optics
  • Optics
  • Photochemistry
  • pKa
  • Polarized MO
  • Polymers
  • Proteins
  • Proton transfer
  • QM/MM
  • Rare earth metals
  • RM1/AM1
  • RM1-COSMO
  • RM1-SCI
  • Self-assembly
  • Solvation
  • Superdelocalizability
  • Vibrations