Maria Pechlaner

11PUBLICATIONS
4CO-AUTHORS
Structural properties of condensed matterCharacterisation of biological macromoleculesRadiation and matterNonlinear optics and spectroscopySolution chemistry
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Publications (11)

|Sep 26, 2025
Use of Measured Residual Dipolar Couplings to Calculate Residual Dipolar Couplings for a Protein Structure: A Case Study Using Hen Egg-White Lysozyme.

Maria Pechlaner, Wilfred F van Gunsteren, Niels Hansen

|Mar 13, 2025
Molecular Structure Refinement of a ß-Heptapeptide Based on Residual Dipolar Couplings: The Challenge of Extracting Structural Information from Measured RDCs.

Maria Pechlaner, Wilfred F van Gunsteren, Lorna J Smith

|Jul 31, 2024
Molecular structure refinement based on residual dipolar couplings using magnetic-field rotational sampling.

Maria Pechlaner, Wilfred F van Gunsteren, Lorna J Smith

|Jun 11, 2024
Molecular Structure Refinement Based on Residual Dipolar Couplings: A Comparison of the Molecular Rotational-Sampling Method with the Alignment-Tensor Approach.

Maria Pechlaner, Wilfred F van Gunsteren, Lorna J Smith

|May 19, 2022
A Method to Derive Structural Information on Molecules from Residual Dipolar Coupling NMR Data.

Wilfred F van Gunsteren, Maria Pechlaner, Lorna J Smith

|Mar 18, 2022
Molecular dynamics simulation or structure refinement of proteins: are solvent molecules required? A case study using hen lysozyme.

Maria Pechlaner, Wilfred F van Gunsteren, Niels Hansen

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