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23 Publications
2018 | Journal Article | LibreCat-ID: 21943
Hruska, E., Abella, J. R., Nüske, F., Kavraki, L. E., & Clementi, C. (2018). Quantitative comparison of adaptive sampling methods for protein dynamics. The Journal of Chemical Physics. https://doi.org/10.1063/1.5053582
LibreCat
| DOI
2018 | Journal Article | LibreCat-ID: 41834
Hansch, M., Hämisch, B., Schweins, R., Prévost, S., & Huber, K. (2018). Liquid-liquid phase separation in dilute solutions of poly(styrene sulfonate) with multivalent cations: Phase diagrams, chain morphology, and impact of temperature. The Journal of Chemical Physics, 148(1), Article 014901. https://doi.org/10.1063/1.5006618
LibreCat
| DOI
2018 | Journal Article | LibreCat-ID: 41832
Urbanski, A., Hansch, M., Lopez, C. G., Schweins, R., Hertle, Y., Hellweg, T., Polzer, F., & Huber, K. (2018). Polyacrylates in the presence of an extraordinary monovalent cation—Solution behavior and metal nanoparticle formation. The Journal of Chemical Physics, 149(16), Article 163318. https://doi.org/10.1063/1.5028182
LibreCat
| DOI
2018 | Journal Article | LibreCat-ID: 41833
Hansch, M., Kaub, H. P., Deck, S., Carl, N., & Huber, K. (2018). Reaction enthalpy from the binding of multivalent cations to anionic polyelectrolytes in dilute solutions. The Journal of Chemical Physics, 148(11), Article 114906. https://doi.org/10.1063/1.5019877
LibreCat
| DOI
2017 | Journal Article | LibreCat-ID: 21938
Nüske, F., Wu, H., Prinz, J.-H., Wehmeyer, C., Clementi, C., & Noé, F. (2017). Markov state models from short non-equilibrium simulations—Analysis and correction of estimation bias. The Journal of Chemical Physics. https://doi.org/10.1063/1.4976518
LibreCat
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2017 | Journal Article | LibreCat-ID: 21939
Wu, H., Nüske, F., Paul, F., Klus, S., Koltai, P., & Noé, F. (2017). Variational Koopman models: Slow collective variables and molecular kinetics from short off-equilibrium simulations. The Journal of Chemical Physics. https://doi.org/10.1063/1.4979344
LibreCat
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2016 | Journal Article | LibreCat-ID: 21937
Nüske, F., Schneider, R., Vitalini, F., & Noé, F. (2016). Variational tensor approach for approximating the rare-event kinetics of macromolecular systems. The Journal of Chemical Physics. https://doi.org/10.1063/1.4940774
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2014 | Journal Article | LibreCat-ID: 10035
Li, Y., Sanna, S., & Schmidt, W. G. (2014). Modeling intrinsic defects in LiNbO3 within the Slater-Janak transition state model. The Journal of Chemical Physics. https://doi.org/10.1063/1.4883737
LibreCat
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2007 | Journal Article | LibreCat-ID: 42000
Goerigk, G., Huber, K., & Schweins, R. (2007). Probing the extent of the Sr2+ ion condensation to anionic polyacrylate coils: A quantitative anomalous small-angle x-ray scattering study. The Journal of Chemical Physics, 127(15), Article 154908. https://doi.org/10.1063/1.2787008
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2005 | Journal Article | LibreCat-ID: 42015
Kramer, T., Schweins, R., & Huber, K. (2005). Small-angle neutron scattering of dilute polystyrene chains at the protein limit of a colloid-polymer mixture. The Journal of Chemical Physics, 123(1), Article 014903. https://doi.org/10.1063/1.1946751
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