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Network-based piecewise linear regression for QSAR modelling
Quantitative Structure-Activity Relationship (QSAR) models are critical in various areas of drug discovery, for example in lead optimisation and virtual screening. Recently, the need for models that are not only predictive but also interpretable has been highlighted. In this paper, a new methodology...
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| Yayımlandı: | J Comput Aided Mol Des |
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| Asıl Yazarlar: | , , |
| Materyal Türü: | Artigo |
| Dil: | Inglês |
| Baskı/Yayın Bilgisi: |
Springer International Publishing
2019
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| Konular: | |
| Online Erişim: | https://ncbi.nlm.nih.gov/pmc/articles/PMC6825651/ https://ncbi.nlm.nih.gov/pubmed/31628660 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1007/s10822-019-00228-6 |
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