Improving prediction of compound function from chemical structure using chemical-genetic networks
Hamid Safizadeh, Scott W. Simpkins, Justin Nelson, Sheena Claire Li, Jeff S. Piotrowski, Mami Yoshimura, Yoko Yashiroda, Hiroyuki Hirano, Hiroyuki Osada, Minoru Yoshida, Charles M. Boone, Chad L. Myers
The paper benchmarks structure descriptors and similarity coefficients using chemical-genetic interaction data to improve compound function prediction.
Journal of Chemical Information and Modeling · Jul 28, 2021Peer-reviewedSystems Biology