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Chemphyschem : a European Journal of Chemical Physics and Physical Chemistry
|
October 31, 2008
Conformational dynamics of minimal elastin-like polypeptides: the role of proline revealed by molecular dynamics and nuclear magnetic resonance
Rachel Glaves, Marcel Baer, Eduard Schreiner, et al.
The Journal of Chemical Physics
|
June 21, 2012
Constrained spin-density dynamics of an iron-sulfur complex: ferredoxin cofactor
Md Ehesan Ali, Nisanth N Nair, Volker Staemmler, et al.
Journal of Chemical Theory and Computation
|
January 14, 2025
Random Sampling Versus Active Learning Algorithms for Machine Learning Potentials of Quantum Liquid Water
Nore Stolte, János Daru, Harald Forbert, et al.
The Journal of Physical Chemistry Letters
|
November 28, 2024
Nuclear Quantum Effects in Liquid Water Are Marginal for Its Average Structure but Significant for Dynamics
Nore Stolte, János Daru, Harald Forbert, et al.
Chemical Science
|
April 1, 2026
Water self-dissociation in slit pores displays non-monotonic behavior as a function of water filling
Sergi Ruiz-Barragan, Daniel Muñoz-Santiburcio, Saskia Körning, et al.
Chemphyschem : a European Journal of Chemical Physics and Physical Chemistry
|
October 27, 2009
Optical, mechanical, and opto-mechanical switching of anchored dithioazobenzene bridges
Robert Turanský, Martin Konôpka, Nikos L Doltsinis, et al.
Nature Chemistry
|
March 11, 2017
Unexpected mechanochemical complexity in the mechanistic scenarios of disulfide bond reduction in alkaline solution
Przemyslaw Dopieralski, Jordi Ribas-Arino, Padmesh Anjukandi, et al.
The Journal of Chemical Physics
|
May 27, 2009
On the applicability of centroid and ring polymer path integral molecular dynamics for vibrational spectroscopy
Alexander Witt, Sergei D Ivanov, Motoyuki Shiga, et al.
Journal of Chemical Theory and Computation
|
December 4, 2015
Magnetostructural Dynamics with the Extended Broken Symmetry Formalism: Antiferromagnetic [2Fe-2S] Complexes
Nisanth N Nair, Eduard Schreiner, Rodolphe Pollet, et al.
Physical Chemistry Chemical Physics : PCCP
|
September 17, 2010
Switching of functionalized azobenzene suspended between gold tips by mechanochemical, photochemical, and opto-mechanical means
Robert Turanský, Martin Konôpka, Nikos L Doltsinis, et al.
Page
of 24
Search research articles
Search
Showing results (171-180 of 235) with videos related to
Sort By:
Page
of 24
Chemphyschem : a European Journal of Chemical Physics and Physical Chemistry
|
October 31, 2008
Conformational dynamics of minimal elastin-like polypeptides: the role of proline revealed by molecular dynamics and nuclear magnetic resonance
Rachel Glaves, Marcel Baer, Eduard Schreiner, et al.
The Journal of Chemical Physics
|
June 21, 2012
Constrained spin-density dynamics of an iron-sulfur complex: ferredoxin cofactor
Md Ehesan Ali, Nisanth N Nair, Volker Staemmler, et al.
Journal of Chemical Theory and Computation
|
January 14, 2025
Random Sampling Versus Active Learning Algorithms for Machine Learning Potentials of Quantum Liquid Water
Nore Stolte, János Daru, Harald Forbert, et al.
The Journal of Physical Chemistry Letters
|
November 28, 2024
Nuclear Quantum Effects in Liquid Water Are Marginal for Its Average Structure but Significant for Dynamics
Nore Stolte, János Daru, Harald Forbert, et al.
Chemical Science
|
April 1, 2026
Water self-dissociation in slit pores displays non-monotonic behavior as a function of water filling
Sergi Ruiz-Barragan, Daniel Muñoz-Santiburcio, Saskia Körning, et al.
Chemphyschem : a European Journal of Chemical Physics and Physical Chemistry
|
October 27, 2009
Optical, mechanical, and opto-mechanical switching of anchored dithioazobenzene bridges
Robert Turanský, Martin Konôpka, Nikos L Doltsinis, et al.
Nature Chemistry
|
March 11, 2017
Unexpected mechanochemical complexity in the mechanistic scenarios of disulfide bond reduction in alkaline solution
Przemyslaw Dopieralski, Jordi Ribas-Arino, Padmesh Anjukandi, et al.
The Journal of Chemical Physics
|
May 27, 2009
On the applicability of centroid and ring polymer path integral molecular dynamics for vibrational spectroscopy
Alexander Witt, Sergei D Ivanov, Motoyuki Shiga, et al.
Journal of Chemical Theory and Computation
|
December 4, 2015
Magnetostructural Dynamics with the Extended Broken Symmetry Formalism: Antiferromagnetic [2Fe-2S] Complexes
Nisanth N Nair, Eduard Schreiner, Rodolphe Pollet, et al.
Physical Chemistry Chemical Physics : PCCP
|
September 17, 2010
Switching of functionalized azobenzene suspended between gold tips by mechanochemical, photochemical, and opto-mechanical means
Robert Turanský, Martin Konôpka, Nikos L Doltsinis, et al.
Page
of 24