1 code implementation • 8 Aug 2022 • Aayush Kumar, Jimiama Mafeni Mase, Divish Rengasamy, Benjamin Rothwell, Mercedes Torres Torres, David A. Winkler, Grazziela P. Figueredo
This paper presents an open-source Python toolbox called Ensemble Feature Importance (EFI) to provide machine learning (ML) researchers, domain experts, and decision makers with robust and accurate feature importance quantification and more reliable mechanistic interpretation of feature importance for prediction problems using fuzzy sets.
no code implementations • 22 Oct 2021 • Divish Rengasamy, Jimiama M. Mase, Mercedes Torres Torres, Benjamin Rothwell, David A. Winkler, Grazziela P. Figueredo
A possible solution to improve the reliability of explanations is to combine results from multiple feature importance quantifiers from different machine learning approaches coupled with re-sampling.
no code implementations • 29 Nov 2020 • Sakshi Piplani, Puneet Singh, David A. Winkler, Nikolai Petrovsky
For fast development of COVID-19, it is only feasible to use drugs (off label use) or approved natural products that are already registered or been assessed for safety in previous human trials.
no code implementations • 1 Sep 2020 • Sakshi Piplani, Puneet Singh, Nikolai Petrovsky, David A. Winkler
We show how the resulting shortlist of candidates with strongest binding affinities is highly enriched in compounds that have been independently identified as potential antivirals against COVID-19.
no code implementations • 13 May 2020 • Sakshi Piplani, Puneet Kumar Singh, David A. Winkler, Nikolai Petrovsky
The devastating impact of the COVID-19 pandemic caused by SARS coronavirus 2 (SARS CoV 2) has raised important questions about viral origin, mechanisms of zoonotic transfer to humans, whether companion or commercial animals can act as reservoirs for infection, and why there are large variations in SARS-CoV-2 susceptibilities across animal species.
no code implementations • 20 Nov 2019 • Marco Fronzi, Mutaz Abu Ghazaleh, Olexandr Isayev, David A. Winkler, Joe Shapter, Michael J. Ford
The screening of novel materials is an important topic in the field of materials science.