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Precision shooting: Sampling long transition pathways

, , и . JOURNAL OF CHEMICAL PHYSICS, (ноября 2008)
DOI: {10.1063/1.2978000}

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Christoph Müller

Der Einfluss von cis-Hydroxy-L-Prolin (CHP) auf die Pankreaskarzinom-Zelllinie DSL6A der Ratte. Uni Rostock, (2009)

Christoph Eggert

Synthese von Modellpolymeren für molekular verstärkte Ionomerblends und Werkstoffeigenschaften. Uni Stuttgart, (2009)

Christoph Thiermann

Grenzüberschreitende Verschmelzungen deutscher Gesellschaften: das Spannungsfeld zwischen Gesellschaftsrecht und Niederlassungsfreiheit des AEUV nach Cartesio. Uni Frankfurt Main, (2010)

Christoph Eibl

Bispidin-Derivate als neue nicotinische Acetylcholinrezeptor-Liganden: Synthese, In-vitro-Pharmakologie und Struktur-Wirkungsbeziehungen. Uni Bonn, (2009)

Christoph Lettowsky

Herstellung zweischichtiger Kunststoff-Hohlkörper durch Gas- und Wasserinjektionstechnik: = Production of two-layer hollow plastics articles by gas and water injection technique. TU Aachen, (2009)
 

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Conditioning Normalizing Flows for Rare Event Sampling., , , , и . CoRR, (2022)Machine-guided path sampling to discover mechanisms of molecular self-organization., , , , , , и . Nat. Comput. Sci., 3 (4): 334-345 (2023)Precision shooting: Sampling long transition pathways, , и . JOURNAL OF CHEMICAL PHYSICS, (ноября 2008)Computing Equilibrium Free Energies Using Non-Equilibrium Molecular Dynamics., и . Entropy, 16 (1): 41-61 (2014)Enhanced Sampling of Configuration and Path Space in a Generalized Ensemble by Shooting Point Exchange., , и . CoRR, (2023)Transition path sampling and the calculation of rate constants, , , и . The Journal of Chemical Physics, 108 (5): 1964-1977 (1998)Dipole moment of water molecules in narrow pores., и . Comput. Phys. Commun., 169 (1-3): 36-39 (2005)Improved description of atomic environments using low-cost polynomial functions with compact support., , и . Mach. Learn. Sci. Technol., 2 (3): 35026 (2021)Optimum bias for fast-switching free energy calculations., и . Comput. Phys. Commun., 179 (1-3): 41-45 (2008)Efficient extraction of free energy profiles from nonequilibrium experiments., и . J. Comput. Chem., 30 (11): 1726-1736 (2009)