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Carlos E S Bernardes

Showing results (1-10 of 47) with videos related to

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Journal of Computational Chemistry|January 20, 2017
AGGREGATES: Finding structures in simulation results of solutionsCarlos E S Bernardes
Journal of Chemical Information and Modeling|March 3, 2022
DLPGEN: Preparing Molecular Dynamics Simulations with Support for Polarizable Force FieldsCarlos E S Bernardes
The Journal of Physical Chemistry. A|March 4, 2015
Evaluation of the OPLS-AA force field for the study of structural and energetic aspects of molecular organic crystalsCarlos E S Bernardes, Abhinav Joseph
Journal of Chemical Theory and Computation|November 2, 2017
Modeling Halogen Bonds in Ionic Liquids: A Force Field for Imidazolium and Halo-Imidazolium DerivativesCarlos E S Bernardes, José N Canongia Lopes
Food Chemistry|November 30, 2023
Isotropic liquid state of cocoa butterDaniel Golodnizky, Carlos E S Bernardes, Maya Davidovich-Pinhas
The Journal of Physical Chemistry. A|September 13, 2008
Energetics of the O-H bond and of intramolecular hydrogen bonding in HOC6H4C(O)Y (Y = H, CH3, CH2CH=CH2, C[triple bond]CH, CH2F, NH2, NHCH3, NO2, OH, OCH3, OCN, CN, F, Cl, SH, and SCH3) compoundsCarlos E S Bernardes, Manuel E Minas da Piedade
Journal of Physics. Condensed Matter : an Institute of Physics Journal|April 30, 2015
Solvent effects on the polar network of ionic liquid solutionsCarlos E S Bernardes, Karina Shimizu, José N Canongia Lopes
Physical Chemistry Chemical Physics : PCCP|March 24, 2015
Modeling the structure and thermodynamics of ferrocenium-based ionic liquidsCarlos E S Bernardes, Tomoyuki Mochida, José N Canongia Lopes
The Journal of Physical Chemistry. B|October 12, 2021
Water Solubility Trends in Ionic Liquids: The Quantitative Structure-Property Relationship Model versus Molecular DynamicsCarlos E S Bernardes, Kyrylo Klimenko, José N Canongia Lopes
The Journal of Physical Chemistry. B|December 24, 2013
Structure and aggregation in the 1-alkyl-3-methylimidazolium bis(trifluoromethylsulfonyl)imide ionic liquid homologous seriesKarina Shimizu, Carlos E S Bernardes, José N Canongia Lopes
Pageof 5

Showing results (1-10 of 47) with videos related to

Sort By:
Pageof 5
Journal of Computational Chemistry|January 20, 2017
AGGREGATES: Finding structures in simulation results of solutionsCarlos E S Bernardes
Journal of Chemical Information and Modeling|March 3, 2022
DLPGEN: Preparing Molecular Dynamics Simulations with Support for Polarizable Force FieldsCarlos E S Bernardes
The Journal of Physical Chemistry. A|March 4, 2015
Evaluation of the OPLS-AA force field for the study of structural and energetic aspects of molecular organic crystalsCarlos E S Bernardes, Abhinav Joseph
Journal of Chemical Theory and Computation|November 2, 2017
Modeling Halogen Bonds in Ionic Liquids: A Force Field for Imidazolium and Halo-Imidazolium DerivativesCarlos E S Bernardes, José N Canongia Lopes
Food Chemistry|November 30, 2023
Isotropic liquid state of cocoa butterDaniel Golodnizky, Carlos E S Bernardes, Maya Davidovich-Pinhas
The Journal of Physical Chemistry. A|September 13, 2008
Energetics of the O-H bond and of intramolecular hydrogen bonding in HOC6H4C(O)Y (Y = H, CH3, CH2CH=CH2, C[triple bond]CH, CH2F, NH2, NHCH3, NO2, OH, OCH3, OCN, CN, F, Cl, SH, and SCH3) compoundsCarlos E S Bernardes, Manuel E Minas da Piedade
Journal of Physics. Condensed Matter : an Institute of Physics Journal|April 30, 2015
Solvent effects on the polar network of ionic liquid solutionsCarlos E S Bernardes, Karina Shimizu, José N Canongia Lopes
Physical Chemistry Chemical Physics : PCCP|March 24, 2015
Modeling the structure and thermodynamics of ferrocenium-based ionic liquidsCarlos E S Bernardes, Tomoyuki Mochida, José N Canongia Lopes
The Journal of Physical Chemistry. B|October 12, 2021
Water Solubility Trends in Ionic Liquids: The Quantitative Structure-Property Relationship Model versus Molecular DynamicsCarlos E S Bernardes, Kyrylo Klimenko, José N Canongia Lopes
The Journal of Physical Chemistry. B|December 24, 2013
Structure and aggregation in the 1-alkyl-3-methylimidazolium bis(trifluoromethylsulfonyl)imide ionic liquid homologous seriesKarina Shimizu, Carlos E S Bernardes, José N Canongia Lopes
Pageof 5