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The Journal of Chemical Physics
|
April 2, 2009
Rate constants calculation with a simple mixed quantum/classical implementation of the flux-flux correlation function method
Juliana Palma
The Journal of Chemical Physics
|
August 3, 2012
A full-dimensional wave packet dynamics study of the photodetachment spectra of FCH4(-)
Juliana Palma, Uwe Manthe
The Journal of Physical Chemistry. A
|
August 14, 2015
A Quasiclassical Study of the F((2)P) + CHD3 (ν1 = 0,1) Reactive System on an Accurate Potential Energy Surface
Juliana Palma, Uwe Manthe
The Journal of Chemical Physics
|
June 10, 2017
Non-adiabatic effects in F + CHD<sub>3</sub> reactive scattering
Juliana Palma, Uwe Manthe
Chemphyschem : a European Journal of Chemical Physics and Physical Chemistry
|
October 26, 2022
On the Uses of PCA to Characterise Molecular Dynamics Simulations of Biological Macromolecules: Basics and Tips for an Effective Use
Juliana Palma, Gustavo Pierdominici-Sottile
ACS Omega
|
May 13, 2024
Fortuitous Correlations in Molecular Dynamics Simulations: Their Harmful Influence on the Probability Distributions of the Main Principal Components
Juliana Palma, Gustavo Pierdominici-Sottile
Journal of Computational Chemistry
|
December 18, 2014
New insights into the meaning and usefulness of principal component analysis of concatenated trajectories
Gustavo Pierdominici-Sottile, Juliana Palma
The Journal of Physical Chemistry. A
|
June 27, 2012
Vibrational dynamics of the CH4·F- complex
Robert Wodraszka, Juliana Palma, Uwe Manthe
The Journal of Physical Chemistry. A
|
July 31, 2019
A Quasi-Classical Evaluation of the <i>J</i>-Shifting Approximation for the Reactive Cross Sections of F + CHD<sub>3</sub> and F + CH<sub>4</sub>
Roman Ellerbrock, Uwe Manthe, Juliana Palma
Methods in Molecular Biology (Clifton, N.J.)
|
January 13, 2024
Dynamics and Function of sRNA/mRNAs Under the Scrutiny of Computational Simulation Methods
Agustín Ormazábal, Juliana Palma, Gustavo Pierdominici-Sottile
Page
of 5
Search research articles
Search
Showing results (1-10 of 41) with videos related to
Sort By:
Page
of 5
The Journal of Chemical Physics
|
April 2, 2009
Rate constants calculation with a simple mixed quantum/classical implementation of the flux-flux correlation function method
Juliana Palma
The Journal of Chemical Physics
|
August 3, 2012
A full-dimensional wave packet dynamics study of the photodetachment spectra of FCH4(-)
Juliana Palma, Uwe Manthe
The Journal of Physical Chemistry. A
|
August 14, 2015
A Quasiclassical Study of the F((2)P) + CHD3 (ν1 = 0,1) Reactive System on an Accurate Potential Energy Surface
Juliana Palma, Uwe Manthe
The Journal of Chemical Physics
|
June 10, 2017
Non-adiabatic effects in F + CHD<sub>3</sub> reactive scattering
Juliana Palma, Uwe Manthe
Chemphyschem : a European Journal of Chemical Physics and Physical Chemistry
|
October 26, 2022
On the Uses of PCA to Characterise Molecular Dynamics Simulations of Biological Macromolecules: Basics and Tips for an Effective Use
Juliana Palma, Gustavo Pierdominici-Sottile
ACS Omega
|
May 13, 2024
Fortuitous Correlations in Molecular Dynamics Simulations: Their Harmful Influence on the Probability Distributions of the Main Principal Components
Juliana Palma, Gustavo Pierdominici-Sottile
Journal of Computational Chemistry
|
December 18, 2014
New insights into the meaning and usefulness of principal component analysis of concatenated trajectories
Gustavo Pierdominici-Sottile, Juliana Palma
The Journal of Physical Chemistry. A
|
June 27, 2012
Vibrational dynamics of the CH4·F- complex
Robert Wodraszka, Juliana Palma, Uwe Manthe
The Journal of Physical Chemistry. A
|
July 31, 2019
A Quasi-Classical Evaluation of the <i>J</i>-Shifting Approximation for the Reactive Cross Sections of F + CHD<sub>3</sub> and F + CH<sub>4</sub>
Roman Ellerbrock, Uwe Manthe, Juliana Palma
Methods in Molecular Biology (Clifton, N.J.)
|
January 13, 2024
Dynamics and Function of sRNA/mRNAs Under the Scrutiny of Computational Simulation Methods
Agustín Ormazábal, Juliana Palma, Gustavo Pierdominici-Sottile
Page
of 5