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Journal of Chemical Theory and Computation
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August 13, 2019
SAXS-Restrained Ensemble Simulations of Intrinsically Disordered Proteins with Commitment to the Principle of Maximum Entropy
Markus R Hermann, Jochen S Hub
Methods in Molecular Biology (Clifton, N.J.)
|
February 14, 2021
Interpreting SAXS/WAXS Data with Explicit-Solvent Simulations: A Practical Guide
Markus R Hermann, Jochen S Hub
Journal of Computer-Aided Molecular Design
|
October 5, 2020
Covalent inhibitor reactivity prediction by the electrophilicity index-in and out of scope
Markus R Hermann, Alexander Pautsch, Marc A Grundl, et al.
Pharmaceuticals (Basel, Switzerland)
|
January 21, 2023
BIreactive: Expanding the Scope of Reactivity Predictions to Propynamides
Markus R Hermann, Christofer S Tautermann, Peter Sieger, et al.
The Journal of Physical Chemistry Letters
|
January 18, 2020
Small-Angle X-ray Scattering Curves of Detergent Micelles: Effects of Asymmetry, Shape Fluctuations, Disorder, and Atomic Details
Miloš T Ivanović, Markus R Hermann, Maciej Wójcik, et al.
Journal of Chemical Information and Modeling
|
April 7, 2020
BIreactive: A Machine-Learning Model to Estimate Covalent Warhead Reactivity
Ferruccio Palazzesi, Markus R Hermann, Marc A Grundl, et al.
Page
of 1
Search research articles
Search
Showing results (1-10 of 6) with videos related to
Sort By:
Page
of 1
Journal of Chemical Theory and Computation
|
August 13, 2019
SAXS-Restrained Ensemble Simulations of Intrinsically Disordered Proteins with Commitment to the Principle of Maximum Entropy
Markus R Hermann, Jochen S Hub
Methods in Molecular Biology (Clifton, N.J.)
|
February 14, 2021
Interpreting SAXS/WAXS Data with Explicit-Solvent Simulations: A Practical Guide
Markus R Hermann, Jochen S Hub
Journal of Computer-Aided Molecular Design
|
October 5, 2020
Covalent inhibitor reactivity prediction by the electrophilicity index-in and out of scope
Markus R Hermann, Alexander Pautsch, Marc A Grundl, et al.
Pharmaceuticals (Basel, Switzerland)
|
January 21, 2023
BIreactive: Expanding the Scope of Reactivity Predictions to Propynamides
Markus R Hermann, Christofer S Tautermann, Peter Sieger, et al.
The Journal of Physical Chemistry Letters
|
January 18, 2020
Small-Angle X-ray Scattering Curves of Detergent Micelles: Effects of Asymmetry, Shape Fluctuations, Disorder, and Atomic Details
Miloš T Ivanović, Markus R Hermann, Maciej Wójcik, et al.
Journal of Chemical Information and Modeling
|
April 7, 2020
BIreactive: A Machine-Learning Model to Estimate Covalent Warhead Reactivity
Ferruccio Palazzesi, Markus R Hermann, Marc A Grundl, et al.
Page
of 1