Biblio
Found 31 results
Filters: Author is Caflisch, A. and Keyword is Molecular Dynamics Simulation [Clear All Filters]
The free energy landscape of small molecule unbinding. PLoS Computational Biology. 7(2):e1002002.
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2011. Small molecule binding to proteins: Affinity and binding/unbinding dynamics from atomistic simulations. ChemMedChem. 6(9):1578-80.
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2011. Free energy surfaces from single-distance information. The Journal of Physical Chemistry B. 114(46):15227-15235.
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2010. A gain-of-function mutation of Arabidopsis cryptochrome1 promotes flowering. Plant Physiology. 154(4):1633-1645.
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2010. On the orientation of the catalytic dyad in aspartic proteases. Proteins. 78(6):1575-1582.
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2010. Slow folding of cross-linked alpha-helical peptides due to steric hindrance. The Journal of Physical Chemistry B. 114(5):2023-2027.
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2010.