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Supporting_Information

All electronic suplementary information of the papers I contribute to

  1. DNA Bases Partition Coefficients: Study of different atomic charges in force fields on their reproduction of the partition coefficients
  2. FreeSolv_HI_MBIS_JCIM2018: Hydration free energies of 614 organic molecules obtained with the MBIS and Hirshfeld-I atomic charges.
  3. Optimizes structures of H2O2, OH and OH* with several DFT methods
  4. Input files for the SAMPL6 logP challenges

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