The Chemistry Development Kit (CDK) v2.0: atom typing, depiction, molecular formulas, and substructure searching

Egon L. Willighagen, John W. Mayfield, Jonathan Alvarsson, Arvid Berg, Lars Carlsson, Nina Jeliazkova, Stefan Kuhn 0001, Tomás Pluskal, Miquel Rojas-Chertó, Ola Spjuth, Gilleain M. Torrance, Chris T. A. Evelo, Rajarshi Guha, Christoph Steinbeck. The Chemistry Development Kit (CDK) v2.0: atom typing, depiction, molecular formulas, and substructure searching. J. Cheminformatics, 9(1), 2017. [doi]

@article{WillighagenMABC17,
  title = {The Chemistry Development Kit (CDK) v2.0: atom typing, depiction, molecular formulas, and substructure searching},
  author = {Egon L. Willighagen and John W. Mayfield and Jonathan Alvarsson and Arvid Berg and Lars Carlsson and Nina Jeliazkova and Stefan Kuhn 0001 and Tomás Pluskal and Miquel Rojas-Chertó and Ola Spjuth and Gilleain M. Torrance and Chris T. A. Evelo and Rajarshi Guha and Christoph Steinbeck},
  year = {2017},
  doi = {10.1186/s13321-017-0220-4},
  url = {https://doi.org/10.1186/s13321-017-0220-4},
  researchr = {https://researchr.org/publication/WillighagenMABC17},
  cites = {0},
  citedby = {0},
  journal = {J. Cheminformatics},
  volume = {9},
  number = {1},
}