Hotspots API: A Python Package for the Detection of Small Molecule Binding Hotspots and Application to Structure-Based Drug Design

Peter R. Curran, Chris J. Radoux, Mihaela D. Smilova, Richard A. Sykes, Alicia P. Higueruelo, Anthony R. Bradley, Brian D. Marsden, David R. Spring, Tom L. Blundell, Andrew R. Leach, William R. Pitt, Jason C. Cole. Hotspots API: A Python Package for the Detection of Small Molecule Binding Hotspots and Application to Structure-Based Drug Design. Journal of Chemical Information and Computer Sciences, 60(4):1911-1916, 2020. [doi]

@article{CurranRSSHBMSBL20,
  title = {Hotspots API: A Python Package for the Detection of Small Molecule Binding Hotspots and Application to Structure-Based Drug Design},
  author = {Peter R. Curran and Chris J. Radoux and Mihaela D. Smilova and Richard A. Sykes and Alicia P. Higueruelo and Anthony R. Bradley and Brian D. Marsden and David R. Spring and Tom L. Blundell and Andrew R. Leach and William R. Pitt and Jason C. Cole},
  year = {2020},
  doi = {10.1021/acs.jcim.9b00996},
  url = {https://doi.org/10.1021/acs.jcim.9b00996},
  researchr = {https://researchr.org/publication/CurranRSSHBMSBL20},
  cites = {0},
  citedby = {0},
  journal = {Journal of Chemical Information and Computer Sciences},
  volume = {60},
  number = {4},
  pages = {1911-1916},
}