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Journal of Chemical Information and Modeling
|
December 10, 2024
Influence of Data Curation and Confidence Levels on Compound Predictions Using Machine Learning Models
Elena Xerxa, Martin Vogt, Jürgen Bajorath
Journal of Computer-Aided Molecular Design
|
August 13, 2016
Maximum common substructure-based Tversky index: an asymmetric hybrid similarity measure
Ryo Kunimoto, Martin Vogt, Jürgen Bajorath
Chemistry (Weinheim an Der Bergstrasse, Germany)
|
September 21, 2004
Monosaccharides as silicon chelators: pentacoordinate bis(diolato)(phenyl)silicates with the cis-furanose isomers of common pentoses and hexoses
Peter Klüfers, Florian Kopp, Martin Vogt
Future Science OA
|
October 2, 2018
Computationally derived compound profiling matrices
Martin Vogt, Swarit Jasial, Jürgen Bajorath
Journal of Chemical Information and Modeling
|
January 22, 2010
Current trends in ligand-based virtual screening: molecular representations, data mining methods, new application areas, and performance evaluation
Hanna Geppert, Martin Vogt, Jürgen Bajorath
Journal of Chemical Information and Modeling
|
August 20, 2013
Searching for closely related ligands with different mechanisms of action using machine learning and mapping algorithms
Jenny Balfer, Martin Vogt, Jürgen Bajorath
Journal of Medicinal Chemistry
|
December 1, 2018
Computational Method to Evaluate Progress in Lead Optimization
Martin Vogt, Dimitar Yonchev, Jürgen Bajorath
Journal of Computer-Aided Molecular Design
|
July 9, 2014
Design of an activity landscape view taking compound-based feature probabilities into account
Bijun Zhang, Martin Vogt, Jürgen Bajorath
Journal of Cheminformatics
|
January 12, 2021
Activity landscape image analysis using convolutional neural networks
Javed Iqbal, Martin Vogt, Jürgen Bajorath
Molecules (Basel, Switzerland)
|
September 3, 2020
Computational Method for Quantitative Comparison of Activity Landscapes on the Basis of Image Data
Javed Iqbal, Martin Vogt, Jürgen Bajorath
Page
of 9
Search research articles
Search
Showing results (21-30 of 87) with videos related to
Sort By:
Page
of 9
Journal of Chemical Information and Modeling
|
December 10, 2024
Influence of Data Curation and Confidence Levels on Compound Predictions Using Machine Learning Models
Elena Xerxa, Martin Vogt, Jürgen Bajorath
Journal of Computer-Aided Molecular Design
|
August 13, 2016
Maximum common substructure-based Tversky index: an asymmetric hybrid similarity measure
Ryo Kunimoto, Martin Vogt, Jürgen Bajorath
Chemistry (Weinheim an Der Bergstrasse, Germany)
|
September 21, 2004
Monosaccharides as silicon chelators: pentacoordinate bis(diolato)(phenyl)silicates with the cis-furanose isomers of common pentoses and hexoses
Peter Klüfers, Florian Kopp, Martin Vogt
Future Science OA
|
October 2, 2018
Computationally derived compound profiling matrices
Martin Vogt, Swarit Jasial, Jürgen Bajorath
Journal of Chemical Information and Modeling
|
January 22, 2010
Current trends in ligand-based virtual screening: molecular representations, data mining methods, new application areas, and performance evaluation
Hanna Geppert, Martin Vogt, Jürgen Bajorath
Journal of Chemical Information and Modeling
|
August 20, 2013
Searching for closely related ligands with different mechanisms of action using machine learning and mapping algorithms
Jenny Balfer, Martin Vogt, Jürgen Bajorath
Journal of Medicinal Chemistry
|
December 1, 2018
Computational Method to Evaluate Progress in Lead Optimization
Martin Vogt, Dimitar Yonchev, Jürgen Bajorath
Journal of Computer-Aided Molecular Design
|
July 9, 2014
Design of an activity landscape view taking compound-based feature probabilities into account
Bijun Zhang, Martin Vogt, Jürgen Bajorath
Journal of Cheminformatics
|
January 12, 2021
Activity landscape image analysis using convolutional neural networks
Javed Iqbal, Martin Vogt, Jürgen Bajorath
Molecules (Basel, Switzerland)
|
September 3, 2020
Computational Method for Quantitative Comparison of Activity Landscapes on the Basis of Image Data
Javed Iqbal, Martin Vogt, Jürgen Bajorath
Page
of 9