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Journal of Chemical Theory and Computation
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November 26, 2015
Generalized Normal Coordinates for the Vibrational Analysis of Molecular Dynamics Simulations
Gerald Mathias, Marcel D Baer
Faraday Discussions
|
June 26, 2013
An ab initio approach to understanding the specific ion effect
Marcel D Baer, Christopher J Mundy
The Journal of Physical Chemistry. B
|
January 21, 2016
Local Aqueous Solvation Structure Around Ca(2+) During Ca(2+)···Cl(-) Pair Formation
Marcel D Baer, Christopher J Mundy
Biophysical Journal
|
February 25, 2021
Atomistic insight on structure and dynamics of spinach acyl carrier protein with substrate length
Marcel D Baer, John Shanklin, Simone Raugei
The Journal of Physical Chemistry. A
|
December 23, 2021
Protonation of Serine in Gas and Condensed and Microsolvated States in Aqueous Solution
Samantha I Johnson, Marcel D Baer, Simone Raugei
The Journal of Physical Chemistry. B
|
February 18, 2016
Divalent Ion Parameterization Strongly Affects Conformation and Interactions of an Anionic Biomimetic Polymer
Michael D Daily, Marcel D Baer, Christopher J Mundy
The Journal of Physical Chemistry. B
|
July 18, 2023
Development of a Systematic and Extensible Force Field for Peptoids (STEPs)
Bradley S Harris, Karteek K Bejagam, Marcel D Baer
The Journal of Chemical Physics
|
June 17, 2018
Understanding the scale of the single ion free energy: A critical test of the tetra-phenyl arsonium and tetra-phenyl borate assumption
Timothy T Duignan, Marcel D Baer, Christopher J Mundy
The Journal of Physical Chemistry Letters
|
May 1, 2025
The Properties That Allow Tuning the Reduction Potentials over a Volt Range in Biological Iron/Sulfur Clusters
Busra Dereli, Marcel D Baer, John W Peters, et al.
Biomacromolecules
|
February 15, 2018
Peptoid Backbone Flexibilility Dictates Its Interaction with Water and Surfaces: A Molecular Dynamics Investigation
Arushi Prakash, Marcel D Baer, Christopher J Mundy, et al.
Page
of 6
Search research articles
Search
Showing results (1-10 of 53) with videos related to
Sort By:
Page
of 6
Journal of Chemical Theory and Computation
|
November 26, 2015
Generalized Normal Coordinates for the Vibrational Analysis of Molecular Dynamics Simulations
Gerald Mathias, Marcel D Baer
Faraday Discussions
|
June 26, 2013
An ab initio approach to understanding the specific ion effect
Marcel D Baer, Christopher J Mundy
The Journal of Physical Chemistry. B
|
January 21, 2016
Local Aqueous Solvation Structure Around Ca(2+) During Ca(2+)···Cl(-) Pair Formation
Marcel D Baer, Christopher J Mundy
Biophysical Journal
|
February 25, 2021
Atomistic insight on structure and dynamics of spinach acyl carrier protein with substrate length
Marcel D Baer, John Shanklin, Simone Raugei
The Journal of Physical Chemistry. A
|
December 23, 2021
Protonation of Serine in Gas and Condensed and Microsolvated States in Aqueous Solution
Samantha I Johnson, Marcel D Baer, Simone Raugei
The Journal of Physical Chemistry. B
|
February 18, 2016
Divalent Ion Parameterization Strongly Affects Conformation and Interactions of an Anionic Biomimetic Polymer
Michael D Daily, Marcel D Baer, Christopher J Mundy
The Journal of Physical Chemistry. B
|
July 18, 2023
Development of a Systematic and Extensible Force Field for Peptoids (STEPs)
Bradley S Harris, Karteek K Bejagam, Marcel D Baer
The Journal of Chemical Physics
|
June 17, 2018
Understanding the scale of the single ion free energy: A critical test of the tetra-phenyl arsonium and tetra-phenyl borate assumption
Timothy T Duignan, Marcel D Baer, Christopher J Mundy
The Journal of Physical Chemistry Letters
|
May 1, 2025
The Properties That Allow Tuning the Reduction Potentials over a Volt Range in Biological Iron/Sulfur Clusters
Busra Dereli, Marcel D Baer, John W Peters, et al.
Biomacromolecules
|
February 15, 2018
Peptoid Backbone Flexibilility Dictates Its Interaction with Water and Surfaces: A Molecular Dynamics Investigation
Arushi Prakash, Marcel D Baer, Christopher J Mundy, et al.
Page
of 6