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Browsing by Author "Davioud-Charvet E."

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AntiMalarial Mode of Action (AMMA) Database: Data Selection, Verification and Chemical Space Analysis

Sidorov P.; Davioud-Charvet E.; Marcou G.; Horvath D.; Varnek A. (2018)

© 2018 Wiley-VCH Verlag GmbH & Co. KGaA, Weinheim This paper presents the effort of collecting and curating a data set of 15461 molecules tested against the malaria parasite, with robust activity and mode of action ...
Electrochemical properties of substituted 2-methyl-1,4-naphthoquinones: Redox behavior predictions

Elhabiri M.; Sidorov P.; Cesar-Rodo E.; Marcou G.; Lanfranchi D.; Davioud-Charvet E.; Horvath D.; Varnek A. (2015)

© 2015 Wiley-VCH Verlag GmbH & Co. KGaA Weinheim. In the context of the investigation of drug-induced oxidative stress in parasitic cells, electrochemical properties of a focused library of polysubstituted menadione ...
Electrochemical Properties of Substituted 2-Methyl-1,4-Naphthoquinones: Redox Behavior Predictions

Elhabiri M.; Sidorov P.; Cesar-Rodo E.; Marcou G.; Lanfranchi D.; Davioud-Charvet E.; Horvath D.; Varnek A. (2015)

© 2014 WILEY-VCH Verlag GmbH & Co. KGaA, Weinheim. In the context of the investigation of drug-induced oxidative stress in parasitic cells, electrochemical properties of a focused library of polysubstituted menadione ...
QSAR modeling and chemical space analysis of antimalarial compounds

Sidorov P.; Viira B.; Davioud-Charvet E.; Maran U.; Marcou G.; Horvath D.; Varnek A. (2017)

© 2017, Springer International Publishing Switzerland.Generative topographic mapping (GTM) has been used to visualize and analyze the chemical space of antimalarial compounds as well as to build predictive models linking ...
Redox Polypharmacology as an Emerging Strategy to Combat Malarial Parasites

Sidorov P.; Desta I.; Chessé M.; Horvath D.; Marcou G.; Varnek A.; Davioud-Charvet E.; Elhabiri M. (2016)

© 2016 WILEY-VCH Verlag GmbH & Co. KGaA, Weinheim3-Benzylmenadiones are potent antimalarial agents that are thought to act through their 3-benzoylmenadione metabolites as redox cyclers of two essential targets: the ...
Redox Polypharmacology as an Emerging Strategy to Combat Malarial Parasites

Sidorov P.; Desta I.; Chessé M.; Horvath D.; Marcou G.; Varnek A.; Davioud-Charvet E.; Elhabiri M. (2016)

© 2016 WILEY-VCH Verlag GmbH & Co. KGaA, Weinheim.3-Benzylmenadiones are potent antimalarial agents that are thought to act through their 3-benzoylmenadione metabolites as redox cyclers of two essential targets: the ...

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Browsing by Author "Davioud-Charvet E."

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