QSAR without borders

Prediction of chemical bioactivity and physical properties has been one of the most important applications of statistical and more recently, machine learning and artificial intelligence methods in chemical sciences. This field of research, broadly known as Quantitative Structure-Activity Relationshi...

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Detalhes bibliográficos
Publicado no:Chem Soc Rev
Main Authors: Muratov, Eugene N., Bajorath, Jürgen, Sheridan, Robert P., Tetko, Igor, Filimonov, Dmitry, Poroikov, Vladimir, Oprea, Tudor I., Baskin, Igor I., Varnek, Alexandre, Roitberg, Adrian, Isayev, Olexandr, Curtarolo, Stefano, Fourches, Denis, Cohen, Yoram, Aspuru-Guzik, Alan, Winkler, David A., Agrafiotis, Dimitris, Cherkasov, Artem, Tropsha, Alexander
Formato: Artigo
Idioma:Inglês
Publicado em: 2020
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Article
Acesso em linha:https://ncbi.nlm.nih.gov/pmc/articles/PMC8008490/
https://ncbi.nlm.nih.gov/pubmed/32356548
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1039/d0cs00098a
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