Data-driven molecular design for discovery and synthesis of novel ligands: a case study on SARS-CoV-2

Jannis Born, Matteo Manica, Joris Cadow, Greta Markert, Nil Adell Mill, Modestas Filipavicius, Nikita Janakarajan, Antonio Cardinale, Teodoro Laino, María Rodríguez Martínez. Data-driven molecular design for discovery and synthesis of novel ligands: a case study on SARS-CoV-2. Mach. Learn. Sci. Technol., 2(2):25024, 2021. [doi]

@article{BornMCMMFJCLM21,
  title = {Data-driven molecular design for discovery and synthesis of novel ligands: a case study on SARS-CoV-2},
  author = {Jannis Born and Matteo Manica and Joris Cadow and Greta Markert and Nil Adell Mill and Modestas Filipavicius and Nikita Janakarajan and Antonio Cardinale and Teodoro Laino and María Rodríguez Martínez},
  year = {2021},
  doi = {10.1088/2632-2153/abe808},
  url = {https://doi.org/10.1088/2632-2153/abe808},
  researchr = {https://researchr.org/publication/BornMCMMFJCLM21},
  cites = {0},
  citedby = {0},
  journal = {Mach. Learn. Sci. Technol.},
  volume = {2},
  number = {2},
  pages = {25024},
}