Is Structure-Based Drug Design Ready for Selectivity Optimization?

Steven K. Albanese, John D. Chodera, Andrea Volkamer, Simon Keng, Robert Abel, Lingle Wang. Is Structure-Based Drug Design Ready for Selectivity Optimization?. Journal of Chemical Information and Computer Sciences, 60(12):6211-6227, 2020. [doi]

@article{AlbaneseCVKAW20,
  title = {Is Structure-Based Drug Design Ready for Selectivity Optimization?},
  author = {Steven K. Albanese and John D. Chodera and Andrea Volkamer and Simon Keng and Robert Abel and Lingle Wang},
  year = {2020},
  doi = {10.1021/acs.jcim.0c00815},
  url = {https://doi.org/10.1021/acs.jcim.0c00815},
  researchr = {https://researchr.org/publication/AlbaneseCVKAW20},
  cites = {0},
  citedby = {0},
  journal = {Journal of Chemical Information and Computer Sciences},
  volume = {60},
  number = {12},
  pages = {6211-6227},
}