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Daniel Sebastiani

Showing results (91-100 of 105) with videos related to

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Angewandte Chemie (International Ed. in English)|October 6, 2012
A strategy for revealing the packing in semicrystalline π-conjugated polymers: crystal structure of bulk poly-3-hexyl-thiophene (P3HT)Dmytro Dudenko, Adam Kiersnowski, Jie Shu, et al.
The Journal of Physical Chemistry Letters|September 15, 2017
Perturbation of the F19-L34 Contact in Amyloid β (1-40) Fibrils Induces Only Local Structural Changes but Abolishes CytotoxicityFelix Hoffmann, Juliane Adler, Bappaditya Chandra, et al.
The Journal of Physical Chemistry. B|July 28, 2007
High-resolution solid-state NMR studies of poly(vinyl phosphonic acid) proton-conducting polymer: molecular structure and proton dynamicsYoung Joo Lee, Bahar Bingöl, Tatiana Murakhtina, et al.
Magnetic Resonance (Gottingen, Germany)|October 31, 2023
The relation between crystal structure and the occurrence of quantum-rotor-induced polarizationCorinna Dietrich, Julia Wissel, Oliver Lorenz, et al.
The Journal of Chemical Physics|November 28, 2012
Foraging on the potential energy surface: a swarm intelligence-based optimizer for molecular geometryChristoph Wehmeyer, Guido Falk von Rudorff, Sebastian Wolf, et al.
Journal of Chemical Theory and Computation|May 20, 2026
Bridging Atomistic and Mesoscale Lithium Transport via Machine-Learned Force Fields and Markov State ModelsMuhammad Nawaz Qaisrani, Christoph Kirsch, Aaron Flötotto, et al.
Journal of the American Chemical Society|August 27, 2019
Ultrafast Proton Transport between a Hydroxy Acid and a Nitrogen Base along Solvent Bridges Governed by the Hydroxide/Methoxide Transfer MechanismMaria Ekimova, Felix Hoffmann, Gül Bekçioğlu-Neff, et al.
Physical Chemistry Chemical Physics : PCCP|January 15, 2015
Proton transfer in a short hydrogen bond caused by solvation shell fluctuations: an ab initio MD and NMR/UV study of an (OHO)(-) bonded systemSvetlana Pylaeva, Christoph Allolio, Benjamin Koeppe, et al.
The Journal of Physical Chemistry Letters|May 15, 2023
Ultrafast Proton Transfer Pathways Mediated by Amphoteric ImidazoleMarius-Andrei Codescu, Thomas Kunze, Moritz Weiß, et al.
The Journal of Physical Chemistry. B|August 12, 2009
Isobaric-isothermal molecular dynamics simulations utilizing density functional theory: an assessment of the structure and density of water at near-ambient conditionsJochen Schmidt, Joost VandeVondele, I-F William Kuo, et al.
Pageof 11

Showing results (91-100 of 105) with videos related to

Sort By:
Pageof 11
Angewandte Chemie (International Ed. in English)|October 6, 2012
A strategy for revealing the packing in semicrystalline π-conjugated polymers: crystal structure of bulk poly-3-hexyl-thiophene (P3HT)Dmytro Dudenko, Adam Kiersnowski, Jie Shu, et al.
The Journal of Physical Chemistry Letters|September 15, 2017
Perturbation of the F19-L34 Contact in Amyloid β (1-40) Fibrils Induces Only Local Structural Changes but Abolishes CytotoxicityFelix Hoffmann, Juliane Adler, Bappaditya Chandra, et al.
The Journal of Physical Chemistry. B|July 28, 2007
High-resolution solid-state NMR studies of poly(vinyl phosphonic acid) proton-conducting polymer: molecular structure and proton dynamicsYoung Joo Lee, Bahar Bingöl, Tatiana Murakhtina, et al.
Magnetic Resonance (Gottingen, Germany)|October 31, 2023
The relation between crystal structure and the occurrence of quantum-rotor-induced polarizationCorinna Dietrich, Julia Wissel, Oliver Lorenz, et al.
The Journal of Chemical Physics|November 28, 2012
Foraging on the potential energy surface: a swarm intelligence-based optimizer for molecular geometryChristoph Wehmeyer, Guido Falk von Rudorff, Sebastian Wolf, et al.
Journal of Chemical Theory and Computation|May 20, 2026
Bridging Atomistic and Mesoscale Lithium Transport via Machine-Learned Force Fields and Markov State ModelsMuhammad Nawaz Qaisrani, Christoph Kirsch, Aaron Flötotto, et al.
Journal of the American Chemical Society|August 27, 2019
Ultrafast Proton Transport between a Hydroxy Acid and a Nitrogen Base along Solvent Bridges Governed by the Hydroxide/Methoxide Transfer MechanismMaria Ekimova, Felix Hoffmann, Gül Bekçioğlu-Neff, et al.
Physical Chemistry Chemical Physics : PCCP|January 15, 2015
Proton transfer in a short hydrogen bond caused by solvation shell fluctuations: an ab initio MD and NMR/UV study of an (OHO)(-) bonded systemSvetlana Pylaeva, Christoph Allolio, Benjamin Koeppe, et al.
The Journal of Physical Chemistry Letters|May 15, 2023
Ultrafast Proton Transfer Pathways Mediated by Amphoteric ImidazoleMarius-Andrei Codescu, Thomas Kunze, Moritz Weiß, et al.
The Journal of Physical Chemistry. B|August 12, 2009
Isobaric-isothermal molecular dynamics simulations utilizing density functional theory: an assessment of the structure and density of water at near-ambient conditionsJochen Schmidt, Joost VandeVondele, I-F William Kuo, et al.
Pageof 11