Calculation of binding affinities for linear alcohols to alpha-cyclodextrin by twin-system enveloping distribution sampling simulations. Fluid phase equilibria, (422):1-17, Elsevier, 2016. [PUMA: mult ubs_10004 ubs_20005 ubs_30058 ubs_40083 ubs_40084 unibibliografie wos]
Using Complementary NMR Data Sets To Detect Inconsistencies and Model Flaws in the Structure Determination of Human Interleukin-4. The journal of physical chemistry. B, Condensed matter, materials, surfaces, interfaces & biophysical chemistry, (121)29:7055-7063, American Chemical Society, 2017. [PUMA: ubs_10004 ubs_20005 ubs_30058 ubs_40083 unibibliografie wos]
On the use of time-averaging restraints when deriving biomolecular structure from 3J-coupling values obtained from NMR experiments. Journal of biomolecular NMR, (66)1:69-83, Springer, 2016. [PUMA: ubs_10004 ubs_20005 ubs_30058 ubs_40083 unibibliografie wos]
Deriving Structural Information from Experimentally Measured Data on Biomolecules. Angewandte Chemie. International edition, (55)52:15990-16010, Wiley-VCH, 2016. [PUMA: ubs_10004 ubs_20005 ubs_30058 ubs_40083 unibibliografie wos]
Interpretation of Seemingly Contradictory Data: Low NMR S-2 Order Parameters Observed in Helices and High NMR S-2 Order Parameters in Disordered Loops of the Protein hGH at Low pH. Chemistry - a European journal, (23)40:9585-9591, Wiley-VCH, 2017. [PUMA: ubs_10004 ubs_20005 ubs_30058 ubs_40083 unibibliografie wos]
Untersuchung der Aggregation von Perylenderivaten in wässriger Lösung mittels atomistischer Simulationen. 2015. [PUMA: hp mult ubs_10004 ubs_20005 ubs_30058 ubs_40083 ubs_40084 unibibliografie]
Molecular Dynamics Simulations of Supramolecular Complexes in Aqueous Solution. 2015. [PUMA: hp mult ubs_10004 ubs_20005 ubs_30058 ubs_40083 ubs_40084 unibibliografie]
MD of Supramolecular Complexes. 2015. [PUMA: hp mult ubs_10004 ubs_20005 ubs_30058 ubs_40083 ubs_40084 unibibliografie]
Modeling and prediction of supramolecular complexes. 2015. [PUMA: ubs_10004 ubs_20005 ubs_30058 ubs_40083 ubs_40084 unibibliografie]
Atomistic Simulations of Supramolecular Complexes in Aqueous Solution - Hünfeld. 2015. [PUMA: hp mult ubs_10004 ubs_20005 ubs_30058 ubs_40083 ubs_40084 unibibliografie]
Atomistic Simulations of Supramolecular Complexes in Aqueous Solution - Athen. 2015. [PUMA: hp mult ubs_10004 ubs_20005 ubs_30058 ubs_40083 ubs_40084 unibibliografie]