38 results on '"Wolf, Steffen"'
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2. Learning protein-ligand unbinding pathways via single-parameter community detection
3. Unsupervised Learning of Object-Centric Embeddings for Cell Instance Segmentation in Microscopy Images
4. Investigation of rare protein conformational transitions via dissipation-corrected targeted molecular dynamics
5. ALE: A Simulation-Based Active Learning Evaluation Framework for the Parameter-Driven Comparison of Query Strategies for NLP
6. Path separation of dissipation-corrected targeted molecular dynamics simulations of protein-ligand unbinding
7. Nonequilibrium Modeling of the Elementary Step in PDZ3 Allosteric Communication
8. Energy Transport and its Function in Heptahelical Transmembrane Proteins
9. Ligand unbinding pathway and mechanism analysis assisted by machine learning and graph methods
10. Molecular origin of driving-dependent friction in fluids
11. Predicting resolved galaxy properties from photometric images using convolutional neural networks
12. The onset of molecule-spanning dynamics in a multi-domain protein
13. Basal delamination during mouse gastrulation primes pluripotent cells for differentiation
14. ALE: A Simulation-Based Active Learning Evaluation Framework for the Parameter-Driven Comparison of Query Strategies for NLP
15. Development of a Steering System for Parasport Sleds Using Lightweight Design and Additive Manufacturing of Fibre-reinforced Polymers
16. Learning Protein–Ligand Unbinding Pathways via Single-Parameter Community Detection
17. A blind validation of a deep-learning solution providing HER2, ER, and PR results from H&E-stained breast cancer specimens.
18. Nonadiabatic dynamics of molecules interacting with metal surfaces: A quantum–classical approach based on Langevin dynamics and the hierarchical equations of motion
19. MD Simulations for D rug‐Target (Un)binding Kinetics
20. Investigation of Rare Protein Conformational Transitions via Dissipation-Corrected Targeted Molecular Dynamics
21. The Onset of Molecule‐Spanning Dynamics in Heat Shock Protein Hsp90
22. Through bonds or contacts? Mapping protein vibrational energy transfer using non-canonical amino acids
23. Predicting Protein–Ligand Binding and Unbinding Kinetics with Biased MD Simulations and Coarse-Graining of Dynamics: Current State and Challenges
24. Anisotropic Friction in a Ligand-Protein Complex
25. Path separation of dissipation-corrected targeted molecular dynamics simulations of protein–ligand unbinding
26. Energy Transport and Its Function in Heptahelical Transmembrane Proteins
27. Nonequilibrium Modeling of the Elementary Step in PDZ3 Allosteric Communication
28. Ligand Unbinding Pathway and Mechanism Analysis Assisted by Machine Learning and Graph Methods
29. Cooperative Protein Allosteric Transition Mediated by a Fluctuating Transmission Network
30. GASP, a generalized framework for agglomerative clustering of signed graphs and its application to Instance Segmentation
31. Molecular Origin of Driving-Dependent Friction in Fluids
32. Temporal control of the integrated stress response by a stochastic molecular switch
33. Predicting Ion Channel Conductance via Dissipation-Corrected Targeted Molecular Dynamics and Langevin Equation Simulations
34. finDr: A web server for in silico D-peptide ligand identification
35. Cooperative protein allosteric transition mediated by a fluctuating transmission network
36. The Mutex Watershed and its Objective: Efficient, Parameter-Free Graph Partitioning
37. Predicting Ion Channel Conductance via Dissipation-Corrected Targeted Molecular Dynamics and Langevin Equation Simulations.
38. 2D-IR Spectroscopy of an AHA Labeled Photoswitchable PDZ2 Domain
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