This file is automatically generated. It contains the descriptions of each uploaded file as provided by the user.

  • h2o-co2_interaction.xyz: Water - carbon dioxide coordinates and interaction energy.
  • lithium_water_interaction.xyz: Lithium - water coordinates and interaction energy.
  • bio-fragment_dimers_energies.xyz: Bio-fragment dimers coordinates with absolute energies and binding energies.
  • water-molecule_polarization.xyz: Lithium - water coordinates and induced polarization vector of water.
  • polypeptides_with_energy_and_polarizability.xyz: Polypeptides coordinates with energies and scalar (L=0) polarizability components.
  • README.txt: README file.