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Prediction and relative scaling approach of Papp <t>for</t> <t>AOH</t> (blue) and AME (yellow) using a comparative <t>QSAR</t> approach. Initial Papp predictions values generated by the ‘QSAR K’ and ‘QSAR L’ models are depicted by plus and cross symbols respectively. In vitro value for AOH is depicted by the circle. Derivation of the final scaled Papp for AME is depicted by the triangle.
Qsar Models, supplied by Kamiya, used in various techniques. Bioz Stars score: 86/100, based on 1 PubMed citations. ZERO BIAS - scores, article reviews, protocol conditions and more
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Databank Inc qsar models
Prediction and relative scaling approach of Papp <t>for</t> <t>AOH</t> (blue) and AME (yellow) using a comparative <t>QSAR</t> approach. Initial Papp predictions values generated by the ‘QSAR K’ and ‘QSAR L’ models are depicted by plus and cross symbols respectively. In vitro value for AOH is depicted by the circle. Derivation of the final scaled Papp for AME is depicted by the triangle.
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Accelrys 2d qsar pharmacophore model
Prediction and relative scaling approach of Papp <t>for</t> <t>AOH</t> (blue) and AME (yellow) using a comparative <t>QSAR</t> approach. Initial Papp predictions values generated by the ‘QSAR K’ and ‘QSAR L’ models are depicted by plus and cross symbols respectively. In vitro value for AOH is depicted by the circle. Derivation of the final scaled Papp for AME is depicted by the triangle.
2d Qsar Pharmacophore Model, supplied by Accelrys, used in various techniques. Bioz Stars score: 86/100, based on 1 PubMed citations. ZERO BIAS - scores, article reviews, protocol conditions and more
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Antares Pharma qsar models
Prediction and relative scaling approach of Papp <t>for</t> <t>AOH</t> (blue) and AME (yellow) using a comparative <t>QSAR</t> approach. Initial Papp predictions values generated by the ‘QSAR K’ and ‘QSAR L’ models are depicted by plus and cross symbols respectively. In vitro value for AOH is depicted by the circle. Derivation of the final scaled Papp for AME is depicted by the triangle.
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Walter de Gruyter GmbH computer-aided drug design: qsar, molecular docking, virtual screening, homology and pharmacophore modeling
Prediction and relative scaling approach of Papp <t>for</t> <t>AOH</t> (blue) and AME (yellow) using a comparative <t>QSAR</t> approach. Initial Papp predictions values generated by the ‘QSAR K’ and ‘QSAR L’ models are depicted by plus and cross symbols respectively. In vitro value for AOH is depicted by the circle. Derivation of the final scaled Papp for AME is depicted by the triangle.
Computer Aided Drug Design: Qsar, Molecular Docking, Virtual Screening, Homology And Pharmacophore Modeling, supplied by Walter de Gruyter GmbH, used in various techniques. Bioz Stars score: 90/100, based on 1 PubMed citations. ZERO BIAS - scores, article reviews, protocol conditions and more
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Joint Research Center qsar model reporting format (qmrf) template
Prediction and relative scaling approach of Papp <t>for</t> <t>AOH</t> (blue) and AME (yellow) using a comparative <t>QSAR</t> approach. Initial Papp predictions values generated by the ‘QSAR K’ and ‘QSAR L’ models are depicted by plus and cross symbols respectively. In vitro value for AOH is depicted by the circle. Derivation of the final scaled Papp for AME is depicted by the triangle.
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Protox Therapeutics qsar modeling oxidative stress classification
Prediction and relative scaling approach of Papp <t>for</t> <t>AOH</t> (blue) and AME (yellow) using a comparative <t>QSAR</t> approach. Initial Papp predictions values generated by the ‘QSAR K’ and ‘QSAR L’ models are depicted by plus and cross symbols respectively. In vitro value for AOH is depicted by the circle. Derivation of the final scaled Papp for AME is depicted by the triangle.
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Kolmar Technologies Inc qsar models
Prediction and relative scaling approach of Papp <t>for</t> <t>AOH</t> (blue) and AME (yellow) using a comparative <t>QSAR</t> approach. Initial Papp predictions values generated by the ‘QSAR K’ and ‘QSAR L’ models are depicted by plus and cross symbols respectively. In vitro value for AOH is depicted by the circle. Derivation of the final scaled Papp for AME is depicted by the triangle.
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Leadscope Inc qsar: derek nexus 6.1.0 leadscope model applier
Prediction and relative scaling approach of Papp <t>for</t> <t>AOH</t> (blue) and AME (yellow) using a comparative <t>QSAR</t> approach. Initial Papp predictions values generated by the ‘QSAR K’ and ‘QSAR L’ models are depicted by plus and cross symbols respectively. In vitro value for AOH is depicted by the circle. Derivation of the final scaled Papp for AME is depicted by the triangle.
Qsar: Derek Nexus 6.1.0 Leadscope Model Applier, supplied by Leadscope Inc, used in various techniques. Bioz Stars score: 90/100, based on 1 PubMed citations. ZERO BIAS - scores, article reviews, protocol conditions and more
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Prediction and relative scaling approach of Papp for AOH (blue) and AME (yellow) using a comparative QSAR approach. Initial Papp predictions values generated by the ‘QSAR K’ and ‘QSAR L’ models are depicted by plus and cross symbols respectively. In vitro value for AOH is depicted by the circle. Derivation of the final scaled Papp for AME is depicted by the triangle.

Journal: bioRxiv

Article Title: Human internal exposures to alternariol and its monomethyl ether are predicted below thresholds of in vitro toxicity by physiologically based kinetic modeling

doi: 10.64898/2026.05.11.724263

Figure Lengend Snippet: Prediction and relative scaling approach of Papp for AOH (blue) and AME (yellow) using a comparative QSAR approach. Initial Papp predictions values generated by the ‘QSAR K’ and ‘QSAR L’ models are depicted by plus and cross symbols respectively. In vitro value for AOH is depicted by the circle. Derivation of the final scaled Papp for AME is depicted by the triangle.

Article Snippet: First, P app values were predicted for both AOH and AME using two QSAR models ( Kamiya et al . 2020 ; ).

Techniques: Generated, In Vitro