44 results on '"Bauer, Matthias R."'
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2. mRNA Display Identifies Potent, Paralog-Selective Peptidic Ligands for ARID1B.
3. Optimization of Potent Ligands for the E3 Ligase DCAF15 and Evaluation of Their Use in Heterobifunctional Degraders.
4. DockStream: a docking wrapper to enhance de novo molecular design
5. Aminobenzothiazole derivatives stabilize the thermolabile p53 cancer mutant Y220C and show anticancer activity in p53-Y220C cell lines
6. Mutant p53 as a therapeutic target for the treatment of triple-negative breast cancer: Preclinical investigation with the anti-p53 drug, PK11007
7. Design and Evaluation of a Low Hydrogen Bond Donor Count Fragment Screening Set to Aid Hit Generation of PROTACs Intended for Oral Delivery
8. 2-Sulfonylpyrimidines : Mild alkylating agents with anticancer activity toward p53-compromised cells
9. Icolos: a workflow manager for structure-based post-processing of de novo generated small molecules
10. Applying DEKOIS 2.0 in structure-based virtual screening to probe the impact of preparation procedures and score normalization
11. Lithocholic acid is an endogenous inhibitor of MDM4 and MDM2
12. Icolos: A workflow manager for structure based post-processing of de novo generated small molecules
13. Inferring multi-target QSAR models with taxonomy-based multi-task learning
14. DockStream: A Docking Wrapper to Enhance De Novo Molecular Design
15. Put a ring on it: application of small aliphatic rings in medicinal chemistry
16. Supporting SARS-CoV-2 Papain-Like Protease Drug Discovery: In silico Methods and Benchmarking
17. Targeting Cavity-Creating p53 Cancer Mutations with Small-Molecule Stabilizers: the Y220X Paradigm
18. A structure-guided molecular chaperone approach for restoring the transcriptional activity of the p53 cancer mutant Y220C
19. Combining effective fragment growing with electrostatic complementarity analysis
20. Probing the impact of protein and ligand preparation procedures on chemotype enrichment in structure-based virtual screening using DEKOIS 2.0 benchmark sets
21. SLMP53-2 Restores Wild-Type-Like Function to Mutant p53 through Hsp70: Promising Activity in Hepatocellular Carcinoma
22. Electrostatic Complementarity as a Fast and Effective Tool to Optimize Binding and Selectivity of Protein–Ligand Complexes
23. Use of DEKOIS 2.0 to gain insights for virtual screening
24. The curcumin analog HO-3867 selectively kills cancer cells by converting mutant p53 protein to transcriptionally active wildtype p53
25. Put a ring on it: application of small aliphatic rings in medicinal chemistryAll authors contributed to writing the manuscript.
26. Targeting mutant p53 with PK11007: A new approach for the treatment of patients with triple-negative breast cancer?
27. Machine Learning Estimates of Natural Product Conformational Energies
28. Anin silicoalgorithm for identifying stabilizing pockets in proteins: test case, the Y220C mutant of the p53 tumor suppressor protein
29. Harnessing Fluorine–Sulfur Contacts and Multipolar Interactions for the Design of p53 Mutant Y220C Rescue Drugs
30. Exploiting Transient Protein States for the Design of Small-Molecule Stabilizers of Mutant p53
31. pROC-Chemotype Plots Enhance the Interpretability of Benchmarking Results in Structure-Based Virtual Screening
32. Experimental and Theoretical Evaluation of the Ethynyl Moiety as a Halogen Bioisostere
33. Hitting a Moving Target: Targeting Transient Protein States
34. Evaluation and Optimization of Virtual Screening Workflows with DEKOIS 2.0 – A Public Library of Challenging Docking Benchmark Sets
35. An in silico algorithm for identifying stabilizing pockets in proteins: test case, the Y220C mutant of the p53 tumor suppressor protein.
36. DEKOIS: Demanding Evaluation Kits for Objective in Silico Screening — A Versatile Tool for Benchmarking Docking Programs and Scoring Functions
37. Synthesis and Molecular Modeling of Novel Tetrahydro-β-carboline Derivatives with Phosphodiesterase 5 Inhibitory and Anticancer Properties
38. Evaluation and Optimization of Virtual Screening Workflowswith DEKOIS 2.0 – A Public Library of Challenging Docking BenchmarkSets.
39. Applying DEKOIS 2.0 in structure-based virtual screening to probe the impact of preparation procedures and score normalization
40. SLMP53-2 Restores Wild-Type-Like Function to Mutant p53 through Hsp70: Promising Activity in Hepatocellular Carcinoma
41. A type III complement factor D deficiency: Structural insights for inhibition of the alternative pathway
42. SLMP53-2 Restores Wild-Type-Like Function to Mutant p53 through Hsp70: Promising Activity in Hepatocellular Carcinoma
43. Machine learning estimates of natural product conformational energies.
44. Synthesis and molecular modeling of novel tetrahydro-β-carboline derivatives with phosphodiesterase 5 inhibitory and anticancer properties.
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