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Molecular Structure Refinement Based on Residual Dipolar Couplings : A Comparison of the Molecular Rotational-Sampling Method with the Alignment-Tensor Approach

, , , , , and . Journal of chemical information and modeling, (2024)
DOI: 10.1021/acs.jcim.4c00416

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A Method to Derive Structural Information on Molecules from Residual Dipolar Coupling NMR Data, , , , and . The journal of physical chemistry. B, Condensed matter, materials, surfaces, interfaces & biophysical, 126 (21): 3867-3888 (2022)Exploring the Effect of Enhanced Sampling on Protein Stability Prediction, , , and . Journal of chemical theory and computation, 18 (4): 2569-2583 (2022)On the use of 3J-coupling NMR data to derive structural information on proteins, , , and . Journal of biomolecular NMR, 75 (1): 39-70 (2021)Molecular Structure Refinement Based on Residual Dipolar Couplings : A Comparison of the Molecular Rotational-Sampling Method with the Alignment-Tensor Approach, , , , , and . Journal of chemical information and modeling, (2024)Supplementary material for 'Exploring the Effect of Enhanced Sampling on Protein Stability Prediction', , , and . Dataset, (2022)Related to: Markthaler, Daniel; Fleck, Maximilian; Stankiewicz, Bartosz; Hansen, Niels: Exploring the Effect of Enhanced Sampling on Protein Stability Prediction. Journal of Chemical Theory and Computation (2022). doi: 10.1021/acs.jctc.1c01012.