Details
Title
Juraskova, Veronika
Sciper ID
286059
Affiliated labs
LCMD
Publications
AMBER and CHARMM Force Fields Inconsistently Portray the Microscopic Details of Phosphorylation
Assessing the persistence of chalcogen bonds in solution with neural network potentials
From Organic Fragments to Photoswitchable Catalysts: The OFF-ON Structural Repository for Transferable Kernel-Based Potentials
How Robust Is the Reversible Steric Shielding Strategy for Photoswitchable Organocatalysts?
Local Kernel Regression and Neural Network Approaches to the Conformational Landscapes of Oligopeptides
Simulating Solvation and Acidity in Complex Mixtures with First-Principles Accuracy: The Case of CH3SO3H and H2O2 in Phenol
Assessing the persistence of chalcogen bonds in solution with neural network potentials
From Organic Fragments to Photoswitchable Catalysts: The OFF-ON Structural Repository for Transferable Kernel-Based Potentials
How Robust Is the Reversible Steric Shielding Strategy for Photoswitchable Organocatalysts?
Local Kernel Regression and Neural Network Approaches to the Conformational Landscapes of Oligopeptides
Simulating Solvation and Acidity in Complex Mixtures with First-Principles Accuracy: The Case of CH3SO3H and H2O2 in Phenol
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