Evaluating Polarizable Biomembrane Simulations against Experiments

Antila, H. S., Dixit, S., Kav, B., Madsen, J. J., Miettinen, M. S. & Ollila, O. H. S., 8 May 2024, In: Journal of Chemical Theory and Computation. 20, 10, p. 4325-4337 13 p.

Research output: Contribution to journal › Article › Scientific › peer-review

Overlay databank unlocks data-driven analyses of biomolecules for all

Kiirikki, A. M., Antila, H. S., Bort, L. S., Buslaev, P., Favela-Rosales, F., Ferreira, T. M., Fuchs, P. F. J., Garcia-Fandino, R., Gushchin, I., Kav, B., Kučerka, N., Kula, P., Kurki, M., Kuzmin, A., Lalitha, A., Lolicato, F., Madsen, J. J., Miettinen, M. S., Mingham, C. & Monticelli, L. & 9 others, Nencini, R., Nesterenko, A. M., Piggot, T. J., Piñeiro, Á., Reuter, N., Samantray, S., Suárez-Lestón, F., Talandashti, R. & Ollila, O. H. S., 7 Feb 2024, In: Nature Communications. 15, 1, 15 p., 1136.

Research output: Contribution to journal › Article › Scientific › peer-review

Probing the dynamic landscape of peptides in molecular assemblies by synergized NMR experiments and MD simulations

Nencini, R., Regnier, M. L. G., Backlund, S. M., Mantzari, E., Dunn, C. D. & Ollila, O. H. S., 13 Feb 2024, In: Communications chemistry. 7, 1, 12 p., 28.

Research output: Contribution to journal › Article › Scientific › peer-review

Rapid Interpretation of Protein Backbone Rotation Dynamics Directly from Spin Relaxation Data

Nencini, R., Mantzari, E., Sandelin, A. E. & Ollila, O. H. S., 1 Oct 2024, In: Journal of Physical Chemistry Letters. p. 10204-10209 6 p.

Research output: Contribution to journal › Article › Scientific › peer-review

Quantitative Comparison against Experiments Reveals Imperfections in Force Fields' Descriptions of POPC-Cholesterol Interactions

Javanainen, M., Heftberger, P., Madsen, J. J., Miettinen, M. S., Pabst, G. & Ollila, O. H. S., Aug 2023, In: Journal of Chemical Theory and Computation. 19, 18, p. 6342–6352 11 p.

Research output: Contribution to journal › Article › Scientific › peer-review