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@article{DBLP:journals/jcisd/StoyanovaKKKSZSM23,
  author       = {Raya Stoyanova and
                  Paul Maximilian Katzberger and
                  Leonid Komissarov and
                  Aous Khadhraoui and
                  Lisa Sach{-}Peltason and
                  Katrin Groebke Zbinden and
                  Torsten Schindler and
                  Nenad Manevski},
  title        = {Computational Predictions of Nonclinical Pharmacokinetics at the Drug
                  Design Stage},
  journal      = {J. Chem. Inf. Model.},
  volume       = {63},
  number       = {2},
  pages        = {442--458},
  year         = {2023},
  url          = {https://doi.org/10.1021/acs.jcim.2c01134},
  doi          = {10.1021/ACS.JCIM.2C01134},
  timestamp    = {Sat, 30 Sep 2023 01:00:00 +0200},
  biburl       = {https://dblp.org/rec/journals/jcisd/StoyanovaKKKSZSM23.bib},
  bibsource    = {dblp computer science bibliography, https://dblp.org}
}

@article{DBLP:journals/jcisd/KomissarovRHV21,
  author       = {Leonid Komissarov and
                  Robert R{\"{u}}ger and
                  Matti Hellstr{\"{o}}m and
                  Toon Verstraelen},
  title        = {ParAMS: Parameter Optimization for Atomistic and Molecular Simulations},
  journal      = {J. Chem. Inf. Model.},
  volume       = {61},
  number       = {8},
  pages        = {3737--3743},
  year         = {2021},
  url          = {https://doi.org/10.1021/acs.jcim.1c00333},
  doi          = {10.1021/ACS.JCIM.1C00333},
  timestamp    = {Sat, 30 Sep 2023 01:00:00 +0200},
  biburl       = {https://dblp.org/rec/journals/jcisd/KomissarovRHV21.bib},
  bibsource    = {dblp computer science bibliography, https://dblp.org}
}

@article{DBLP:journals/jcisd/KomissarovV21,
  author       = {Leonid Komissarov and
                  Toon Verstraelen},
  title        = {Improving the Silicon Interactions of GFN-xTB},
  journal      = {J. Chem. Inf. Model.},
  volume       = {61},
  number       = {12},
  pages        = {5931--5937},
  year         = {2021},
  url          = {https://doi.org/10.1021/acs.jcim.1c01170},
  doi          = {10.1021/ACS.JCIM.1C01170},
  timestamp    = {Fri, 21 Jan 2022 00:00:00 +0100},
  biburl       = {https://dblp.org/rec/journals/jcisd/KomissarovV21.bib},
  bibsource    = {dblp computer science bibliography, https://dblp.org}
}