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Journal of Chemical Information and Modeling
|
June 1, 2005
Human rhinovirus 3C protease: generation of pharmacophore models for peptidic and nonpeptidic inhibitors and their application in virtual screening
Theodora Steindl, Christian Laggner, Thierry Langer
Journal of Chemical Information and Modeling
|
April 6, 2005
Comparative analysis of protein-bound ligand conformations with respect to catalyst's conformational space subsampling algorithms
Johannes Kirchmair, Christian Laggner, Gerhard Wolber, et al.
Journal of Chemical Information and Modeling
|
May 23, 2006
Influence of the conditions in pharmacophore generation, scoring, and 3D database search for chemical feature-based pharmacophore models: one application study of ETA- and ETB-selective antagonists
Joan R Cucarull-González, Christian Laggner, Thierry Langer
Journal of Cellular and Molecular Medicine
|
October 20, 2023
A novel binding pocket in the D2 domain of protein tyrosine phosphatase mu (PTPmu) guides AI screen to identify small molecules that modulate tumour cell adhesion, growth and migration
Kathleen Molyneaux, Christian Laggner, Susann M Brady-Kalnay
International Journal of Molecular Sciences
|
March 11, 2023
Artificial Intelligence-Based Computational Screening and Functional Assays Identify Candidate Small Molecule Antagonists of PTPmu-Dependent Adhesion
Kathleen Molyneaux, Christian Laggner, Susann M Brady-Kalnay
Journal of Chemical Information and Modeling
|
July 25, 2006
Comparative performance assessment of the conformational model generators omega and catalyst: a large-scale survey on the retrieval of protein-bound ligand conformations
Johannes Kirchmair, Gerhard Wolber, Christian Laggner, et al.
Plos One
|
July 26, 2023
Small molecule antagonists of PTPmu identified by artificial intelligence-based computational screening block glioma cell migration and growth
Kathleen Molyneaux, Christian Laggner, Jason Vincent, et al.
Current Drug Discovery Technologies
|
May 23, 2006
Development and validation of an in silico P450 profiler based on pharmacophore models
Daniela Schuster, Christian Laggner, Theodora M Steindl, et al.
Journal of Chemical Information and Modeling
|
September 26, 2006
Parallel screening: a novel concept in pharmacophore modeling and virtual screening
Theodora M Steindl, Daniela Schuster, Christian Laggner, et al.
Journal of Computer-Aided Molecular Design
|
October 26, 2007
Pharmacophore modeling and parallel screening for PPAR ligands
Patrick Markt, Daniela Schuster, Johannes Kirchmair, et al.
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of 5
Search research articles
Search
Showing results (1-10 of 46) with videos related to
Sort By:
Page
of 5
Journal of Chemical Information and Modeling
|
June 1, 2005
Human rhinovirus 3C protease: generation of pharmacophore models for peptidic and nonpeptidic inhibitors and their application in virtual screening
Theodora Steindl, Christian Laggner, Thierry Langer
Journal of Chemical Information and Modeling
|
April 6, 2005
Comparative analysis of protein-bound ligand conformations with respect to catalyst's conformational space subsampling algorithms
Johannes Kirchmair, Christian Laggner, Gerhard Wolber, et al.
Journal of Chemical Information and Modeling
|
May 23, 2006
Influence of the conditions in pharmacophore generation, scoring, and 3D database search for chemical feature-based pharmacophore models: one application study of ETA- and ETB-selective antagonists
Joan R Cucarull-González, Christian Laggner, Thierry Langer
Journal of Cellular and Molecular Medicine
|
October 20, 2023
A novel binding pocket in the D2 domain of protein tyrosine phosphatase mu (PTPmu) guides AI screen to identify small molecules that modulate tumour cell adhesion, growth and migration
Kathleen Molyneaux, Christian Laggner, Susann M Brady-Kalnay
International Journal of Molecular Sciences
|
March 11, 2023
Artificial Intelligence-Based Computational Screening and Functional Assays Identify Candidate Small Molecule Antagonists of PTPmu-Dependent Adhesion
Kathleen Molyneaux, Christian Laggner, Susann M Brady-Kalnay
Journal of Chemical Information and Modeling
|
July 25, 2006
Comparative performance assessment of the conformational model generators omega and catalyst: a large-scale survey on the retrieval of protein-bound ligand conformations
Johannes Kirchmair, Gerhard Wolber, Christian Laggner, et al.
Plos One
|
July 26, 2023
Small molecule antagonists of PTPmu identified by artificial intelligence-based computational screening block glioma cell migration and growth
Kathleen Molyneaux, Christian Laggner, Jason Vincent, et al.
Current Drug Discovery Technologies
|
May 23, 2006
Development and validation of an in silico P450 profiler based on pharmacophore models
Daniela Schuster, Christian Laggner, Theodora M Steindl, et al.
Journal of Chemical Information and Modeling
|
September 26, 2006
Parallel screening: a novel concept in pharmacophore modeling and virtual screening
Theodora M Steindl, Daniela Schuster, Christian Laggner, et al.
Journal of Computer-Aided Molecular Design
|
October 26, 2007
Pharmacophore modeling and parallel screening for PPAR ligands
Patrick Markt, Daniela Schuster, Johannes Kirchmair, et al.
Page
of 5