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Stumpfe, Dagmar
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1

Introducing the metacore concept for multi-target ligand de..:

Stumpfe, Dagmar ; Hoch, Alexander ; Bajorath, Jürgen
RSC Medicinal Chemistry.  12 (2021)  4 - p. 628-635 , 2021
Link: https://doi.org/10.1039/..
 
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2

Data-Driven Analysis of Fluorination of Ligands of Aminergi..:

Pietruś, Wojciech ; Kurczab, Rafał ; Stumpfe, Dagmar..
Biomolecules.  11 (2021)  11 - p. 1647 , 2021
Link: https://doi.org/10.3390/..
 
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3

Systematic Data Analysis and Diagnostic Machine Learning Re..:

Feldmann, Christian ; Yonchev, Dimitar ; Stumpfe, Dagmar.
Molecular Pharmaceutics.  17 (2020)  12 - p. 4652-4666 , 2020
Link: https://doi.org/10.1021/..
 
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4

Advances in exploring activity cliffs:

Stumpfe, Dagmar ; Hu, Huabin ; Bajorath, Jürgen
Journal of Computer-Aided Molecular Design.  34 (2020)  9 - p. 929-942 , 2020
Link: https://doi.org/10.1007/..
 
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5

Computational method for the identification of third genera..:

Stumpfe, Dagmar ; Hu, Huabin ; Bajorath, Jürgen
MethodsX.  7 (2020)  - p. 100793 , 2020
Link: https://doi.org/10.1016/..
 
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6

Current Trends, Overlooked Issues, and Unmet Challenges in ..:

Stumpfe, Dagmar ; Bajorath, Jürgen
Journal of Chemical Information and Modeling.  60 (2020)  9 - p. 4112-4115 , 2020
Link: https://doi.org/10.1021/..
 
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7

Introducing a new category of activity cliffs with chemical..:

Stumpfe, Dagmar ; Hu, Huabin ; Bajorath, Jürgen
Bioorganic & Medicinal Chemistry.  27 (2019)  16 - p. 3605-3612 , 2019
Link: https://doi.org/10.1016/..
 
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8

Systematic Identification of Target Set-Dependent Activity ..:

Hu, Huabin ; Stumpfe, Dagmar ; Bajorath, Jürgen
Future Science OA.  5 (2019)  2 - p. , 2019
Link: https://doi.org/10.4155/..
 
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9

Exploration of Target Synergy in Cancer Treatment by Cell-B..:

Naveja, J. Jesús ; Stumpfe, Dagmar ; Medina-Franco, José L..
Journal of Chemical Information and Modeling.  59 (2019)  6 - p. 3072-3079 , 2019
Link: https://doi.org/10.1021/..
 
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10

Series of Screening Compounds with High Hit Rates for the E..:

Stumpfe, Dagmar ; Gilberg, Erik ; Bajorath, Jürgen
Future Science OA.  4 (2018)  3 - p. , 2018
Link: https://doi.org/10.4155/..
 
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11

Redundancy in two major compound databases:

Yonchev, Dimitar ; Dimova, Dilyana ; Stumpfe, Dagmar..
Drug Discovery Today.  23 (2018)  6 - p. 1183-1186 , 2018
Link: https://doi.org/10.1016/..
 
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12

Computational Design of New Molecular Scaffolds for Medicin..:

Dimova, Dilyana ; Stumpfe, Dagmar ; Bajorath, Jürgen
Future Science OA.  4 (2017)  2 - p. , 2017
Link: https://doi.org/10.4155/..
 
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13

Activity profiles of analog series containing pan assay int..:

Gilberg, Erik ; Stumpfe, Dagmar ; Bajorath, Jürgen
RSC Advances.  7 (2017)  57 - p. 35638-35647 , 2017
Link: https://doi.org/10.1039/..
 
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14

Towards a systematic assessment of assay interference: Iden..:

Gilberg, Erik ; Stumpfe, Dagmar ; Bajorath, Jürgen
F1000Research.  6 (2017)  - p. 1505 , 2017
Link: https://doi.org/10.12688..
 
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15

Systematic analysis of structural and activity relationship..:

Stumpfe, Dagmar ; Dimova, Dilyana ; Bajorath, Jürgen
RSC Advances.  7 (2017)  30 - p. 18718-18723 , 2017
Link: https://doi.org/10.1039/..
 
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