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The Journal of Physical Chemistry. A
|
August 22, 2009
Prediction of the intrinsic hydrogen bond acceptor strength of chemical substances from molecular structure
Johannes Schwöbel, Ralf-Uwe Ebert, Ralph Kühne, et al.
Journal of Chemical Information and Modeling
|
March 20, 2009
Prediction of the intrinsic hydrogen bond acceptor strength of organic compounds by local molecular parameters
Johannes Schwöbel, Ralf-Uwe Ebert, Ralph Kühne, et al.
Journal of Chemical Information and Modeling
|
July 27, 2011
Prediction of the dissociation constant pKa of organic acids from local molecular parameters of their electronic ground state
Haiying Yu, Ralph Kühne, Ralf-Uwe Ebert, et al.
Chemical Research in Toxicology
|
August 20, 2003
Stepwise discrimination between four modes of toxic action of phenols in the Tetrahymena pyriformis assay
Gerrit Schüürmann, Aynur O Aptula, Ralph Kühne, et al.
Journal of Chemical Information and Modeling
|
October 29, 2008
External validation and prediction employing the predictive squared correlation coefficient test set activity mean vs training set activity mean
Gerrit Schüürmann, Ralf-Uwe Ebert, Jingwen Chen, et al.
Journal of Chemical Information and Modeling
|
July 30, 2010
Tautomer identification and tautomer structure generation based on the InChI code
Torsten Thalheim, Armin Vollmer, Ralf-Uwe Ebert, et al.
Journal of Cheminformatics
|
April 21, 2025
Prediction of the water solubility by a graph convolutional-based neural network on a highly curated dataset
Nadin Ulrich, Karsten Voigt, Anton Kudria, et al.
Environment International
|
January 7, 2016
Inhalation threshold of toxicological concern (TTC) - Structural alerts discriminate high from low repeated-dose inhalation toxicity
Gerrit Schüürmann, Ralf-Uwe Ebert, Inga Tluczkiewicz, et al.
Environmental Toxicology and Chemistry
|
November 9, 2006
Acute to chronic ratios in aquatic toxicity--variation across trophic levels and relationship with chemical structure
Jan Ahlers, Caroline Riedhammer, Michaela Vogliano, et al.
The Science of the Total Environment
|
May 20, 2024
Assessment, distribution, and ecological risk of contaminants of emerging concern in a surface water-sediment-fish system impacted by wastewater
Diana P Manjarrés-López, Nicola Montemurro, Nadin Ulrich, et al.
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of 3
Search research articles
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Showing results (11-20 of 23) with videos related to
Sort By:
Page
of 3
The Journal of Physical Chemistry. A
|
August 22, 2009
Prediction of the intrinsic hydrogen bond acceptor strength of chemical substances from molecular structure
Johannes Schwöbel, Ralf-Uwe Ebert, Ralph Kühne, et al.
Journal of Chemical Information and Modeling
|
March 20, 2009
Prediction of the intrinsic hydrogen bond acceptor strength of organic compounds by local molecular parameters
Johannes Schwöbel, Ralf-Uwe Ebert, Ralph Kühne, et al.
Journal of Chemical Information and Modeling
|
July 27, 2011
Prediction of the dissociation constant pKa of organic acids from local molecular parameters of their electronic ground state
Haiying Yu, Ralph Kühne, Ralf-Uwe Ebert, et al.
Chemical Research in Toxicology
|
August 20, 2003
Stepwise discrimination between four modes of toxic action of phenols in the Tetrahymena pyriformis assay
Gerrit Schüürmann, Aynur O Aptula, Ralph Kühne, et al.
Journal of Chemical Information and Modeling
|
October 29, 2008
External validation and prediction employing the predictive squared correlation coefficient test set activity mean vs training set activity mean
Gerrit Schüürmann, Ralf-Uwe Ebert, Jingwen Chen, et al.
Journal of Chemical Information and Modeling
|
July 30, 2010
Tautomer identification and tautomer structure generation based on the InChI code
Torsten Thalheim, Armin Vollmer, Ralf-Uwe Ebert, et al.
Journal of Cheminformatics
|
April 21, 2025
Prediction of the water solubility by a graph convolutional-based neural network on a highly curated dataset
Nadin Ulrich, Karsten Voigt, Anton Kudria, et al.
Environment International
|
January 7, 2016
Inhalation threshold of toxicological concern (TTC) - Structural alerts discriminate high from low repeated-dose inhalation toxicity
Gerrit Schüürmann, Ralf-Uwe Ebert, Inga Tluczkiewicz, et al.
Environmental Toxicology and Chemistry
|
November 9, 2006
Acute to chronic ratios in aquatic toxicity--variation across trophic levels and relationship with chemical structure
Jan Ahlers, Caroline Riedhammer, Michaela Vogliano, et al.
The Science of the Total Environment
|
May 20, 2024
Assessment, distribution, and ecological risk of contaminants of emerging concern in a surface water-sediment-fish system impacted by wastewater
Diana P Manjarrés-López, Nicola Montemurro, Nadin Ulrich, et al.
Page
of 3