Toolkit for the Construction of Reproducing Kernel-Based Representations of Data: Application to Multidimensional Potential Energy Surfaces

Oliver T. Unke, Markus Meuwly. Toolkit for the Construction of Reproducing Kernel-Based Representations of Data: Application to Multidimensional Potential Energy Surfaces. Journal of Chemical Information and Computer Sciences, 57(8):1923-1931, August 2017. [doi]

@article{UnkeM17,
  title = {Toolkit for the Construction of Reproducing Kernel-Based Representations of Data: Application to Multidimensional Potential Energy Surfaces},
  author = {Oliver T. Unke and Markus Meuwly},
  year = {2017},
  month = {August},
  doi = {10.1021/acs.jcim.7b00090},
  url = {https://doi.org/10.1021/acs.jcim.7b00090},
  researchr = {https://researchr.org/publication/UnkeM17},
  cites = {0},
  citedby = {0},
  journal = {Journal of Chemical Information and Computer Sciences},
  volume = {57},
  number = {8},
  pages = {1923-1931},
}