Systematic assessment of scaffold distances in ChEMBL: prioritization of compound data sets for scaffold hopping analysis in virtual screening

Ruifang Li, Jürgen Bajorath. Systematic assessment of scaffold distances in ChEMBL: prioritization of compound data sets for scaffold hopping analysis in virtual screening. Journal of Computer-Aided Molecular Design, 26(10):1101-1109, 2012. [doi]

@article{LiB12-6,
  title = {Systematic assessment of scaffold distances in ChEMBL: prioritization of compound data sets for scaffold hopping analysis in virtual screening},
  author = {Ruifang Li and Jürgen Bajorath},
  year = {2012},
  doi = {10.1007/s10822-012-9603-9},
  url = {http://dx.doi.org/10.1007/s10822-012-9603-9},
  researchr = {https://researchr.org/publication/LiB12-6},
  cites = {0},
  citedby = {0},
  journal = {Journal of Computer-Aided Molecular Design},
  volume = {26},
  number = {10},
  pages = {1101-1109},
}