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Physical Chemistry Chemical Physics : PCCP
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September 22, 2010
Study of the optical and magnetic properties of pyrimidine in water combining PCM and QM/MM methodologies
Vinícius Manzoni, Marcelo L Lyra, Rodrigo M Gester, et al.
Journal of Chemical Theory and Computation
|
May 4, 2021
Molecular Dynamics Approach to Calculate the Thermodiffusion (Soret and Seebeck) Coefficients of Salts in Aqueous Solutions
Leandro Rezende Franco, André Luiz Sehnem, Antônio Martins Figueiredo Neto, et al.
Journal of Chemical Theory and Computation
|
May 24, 2024
Novel Approach for Predicting Vertical Electron Attachment Energies in Bulk-Solvated Molecules
Matheus B Kiataki, Márcio T do N Varella, Kaline Coutinho, et al.
The Journal of Physical Chemistry. B
|
October 9, 2024
Does Positron Attachment Take Place in Water Solution?
Mateus Bergami, Jorge Charry, Andres Reyes, et al.
The Journal of Chemical Physics
|
January 15, 2009
Dynamic polarizability, Cauchy moments, and the optical absorption spectrum of liquid water: a sequential molecular dynamics/quantum mechanical approach
Ricardo A Mata, Benedito J Costa Cabral, Claude Millot, et al.
The Journal of Chemical Physics
|
December 31, 2020
A new interpretation of the absorption and the dual fluorescence of Prodan in solution
Cíntia C Vequi-Suplicy, Yoelvis Orozco-Gonzalez, M Teresa Lamy, et al.
Journal of Molecular Modeling
|
February 22, 2018
Theoretical study of the NMR chemical shift of Xe in supercritical condition
Evanildo G Lacerda, Stephan P A Sauer, Kurt V Mikkelsen, et al.
Biophysical Reviews
|
September 24, 2017
Experimental and theoretical studies of emodin interacting with a lipid bilayer of DMPC
Antonio R da Cunha, Evandro L Duarte, Hubert Stassen, et al.
The Journal of Chemical Physics
|
June 10, 2010
Delocalized water and fluoride contributions to Dyson orbitals for electron detachment from the hydrated fluoride anion
Sylvio Canuto, Kaline Coutinho, Benedito J C Cabral, et al.
RSC Advances
|
April 15, 2022
Simulations reveal that antimicrobial BP100 induces local membrane thinning, slows lipid dynamics and favors water penetration
Leandro R Franco, Peter Park, Hernan Chaimovich, et al.
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of 7
Search research articles
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Showing results (31-40 of 62) with videos related to
Sort By:
Page
of 7
Physical Chemistry Chemical Physics : PCCP
|
September 22, 2010
Study of the optical and magnetic properties of pyrimidine in water combining PCM and QM/MM methodologies
Vinícius Manzoni, Marcelo L Lyra, Rodrigo M Gester, et al.
Journal of Chemical Theory and Computation
|
May 4, 2021
Molecular Dynamics Approach to Calculate the Thermodiffusion (Soret and Seebeck) Coefficients of Salts in Aqueous Solutions
Leandro Rezende Franco, André Luiz Sehnem, Antônio Martins Figueiredo Neto, et al.
Journal of Chemical Theory and Computation
|
May 24, 2024
Novel Approach for Predicting Vertical Electron Attachment Energies in Bulk-Solvated Molecules
Matheus B Kiataki, Márcio T do N Varella, Kaline Coutinho, et al.
The Journal of Physical Chemistry. B
|
October 9, 2024
Does Positron Attachment Take Place in Water Solution?
Mateus Bergami, Jorge Charry, Andres Reyes, et al.
The Journal of Chemical Physics
|
January 15, 2009
Dynamic polarizability, Cauchy moments, and the optical absorption spectrum of liquid water: a sequential molecular dynamics/quantum mechanical approach
Ricardo A Mata, Benedito J Costa Cabral, Claude Millot, et al.
The Journal of Chemical Physics
|
December 31, 2020
A new interpretation of the absorption and the dual fluorescence of Prodan in solution
Cíntia C Vequi-Suplicy, Yoelvis Orozco-Gonzalez, M Teresa Lamy, et al.
Journal of Molecular Modeling
|
February 22, 2018
Theoretical study of the NMR chemical shift of Xe in supercritical condition
Evanildo G Lacerda, Stephan P A Sauer, Kurt V Mikkelsen, et al.
Biophysical Reviews
|
September 24, 2017
Experimental and theoretical studies of emodin interacting with a lipid bilayer of DMPC
Antonio R da Cunha, Evandro L Duarte, Hubert Stassen, et al.
The Journal of Chemical Physics
|
June 10, 2010
Delocalized water and fluoride contributions to Dyson orbitals for electron detachment from the hydrated fluoride anion
Sylvio Canuto, Kaline Coutinho, Benedito J C Cabral, et al.
RSC Advances
|
April 15, 2022
Simulations reveal that antimicrobial BP100 induces local membrane thinning, slows lipid dynamics and favors water penetration
Leandro R Franco, Peter Park, Hernan Chaimovich, et al.
Page
of 7