Data structures for computational compound promiscuity analysis and exemplary applications to inhibitors of the human kinome

Filip Miljkovic, Jürgen Bajorath. Data structures for computational compound promiscuity analysis and exemplary applications to inhibitors of the human kinome. Journal of Computer-Aided Molecular Design, 34(1):1-10, 2020. [doi]

@article{MiljkovicB20,
  title = {Data structures for computational compound promiscuity analysis and exemplary applications to inhibitors of the human kinome},
  author = {Filip Miljkovic and Jürgen Bajorath},
  year = {2020},
  doi = {10.1007/s10822-019-00266-0},
  url = {https://doi.org/10.1007/s10822-019-00266-0},
  researchr = {https://researchr.org/publication/MiljkovicB20},
  cites = {0},
  citedby = {0},
  journal = {Journal of Computer-Aided Molecular Design},
  volume = {34},
  number = {1},
  pages = {1-10},
}