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Physical Chemistry Chemical Physics : PCCP
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March 19, 2015
Multiple active zones in hybrid QM/MM molecular dynamics simulations for large biomolecular systems
Juan Torras
Chemical Communications (Cambridge, England)
|
February 9, 2018
Massive quantum regions for simulations on bio-nanomaterials: synthetic ferritin nanocages
Juan Torras, Carlos Alemán
The Journal of Physical Chemistry. B
|
August 16, 2013
Determination of new Cu+, Cu2+, and Zn2+ Lennard-Jones ion parameters in acetonitrile
Juan Torras, Carlos Alemán
The Journal of Physical Chemistry. B
|
March 11, 2011
Structural and electronic properties of poly[N-(2-cyanoalkyl)pyrrole]s bearing small alkyl groups
David Aradilla, Juan Torras, Carlos Alemán
The Journal of Physical Chemistry. A
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June 21, 2012
Reviewing extrapolation procedures of the electronic properties on the π-conjugated polymer limit
Juan Torras, Jordi Casanovas, Carlos Alemán
Biotechnology and Applied Biochemistry
|
August 10, 2017
Molecular dynamics study on the Apo- and Holo-forms of 5-lipoxygenase
Juan Torras, Mauro Maccarrone, Enrico Dainese
The Journal of Physical Chemistry. B
|
October 28, 2009
Structural and electronic properties of poly(thiaheterohelicene)s
Juan Torras, Oscar Bertran, Carlos Alemán
ACS Applied Bio Materials
|
November 13, 2025
Soft, Sustainable, and Sensitive: Biopolymer-Based Hydrogels as Recyclable Temperature Sensors for Skin-Integrated Electronics
David Naranjo, Juan Torras, Jose García-Torres
Journal of Computational Chemistry
|
August 27, 2010
Incorporation of deMon2k as a new parallel quantum mechanical code for the PUPIL system
Oscar Bertran, S B Trickey, Juan Torras
Journal of Chemical Theory and Computation
|
September 20, 2016
Multiscale Treatment for the Molecular Mechanism of a Diels-Alder Reaction in Solution: A QM/MM-MD Study
Jorge Soto-Delgado, Ricardo A Tapia, Juan Torras
Page
of 9
Search research articles
Search
Showing results (1-10 of 88) with videos related to
Sort By:
Page
of 9
Physical Chemistry Chemical Physics : PCCP
|
March 19, 2015
Multiple active zones in hybrid QM/MM molecular dynamics simulations for large biomolecular systems
Juan Torras
Chemical Communications (Cambridge, England)
|
February 9, 2018
Massive quantum regions for simulations on bio-nanomaterials: synthetic ferritin nanocages
Juan Torras, Carlos Alemán
The Journal of Physical Chemistry. B
|
August 16, 2013
Determination of new Cu+, Cu2+, and Zn2+ Lennard-Jones ion parameters in acetonitrile
Juan Torras, Carlos Alemán
The Journal of Physical Chemistry. B
|
March 11, 2011
Structural and electronic properties of poly[N-(2-cyanoalkyl)pyrrole]s bearing small alkyl groups
David Aradilla, Juan Torras, Carlos Alemán
The Journal of Physical Chemistry. A
|
June 21, 2012
Reviewing extrapolation procedures of the electronic properties on the π-conjugated polymer limit
Juan Torras, Jordi Casanovas, Carlos Alemán
Biotechnology and Applied Biochemistry
|
August 10, 2017
Molecular dynamics study on the Apo- and Holo-forms of 5-lipoxygenase
Juan Torras, Mauro Maccarrone, Enrico Dainese
The Journal of Physical Chemistry. B
|
October 28, 2009
Structural and electronic properties of poly(thiaheterohelicene)s
Juan Torras, Oscar Bertran, Carlos Alemán
ACS Applied Bio Materials
|
November 13, 2025
Soft, Sustainable, and Sensitive: Biopolymer-Based Hydrogels as Recyclable Temperature Sensors for Skin-Integrated Electronics
David Naranjo, Juan Torras, Jose García-Torres
Journal of Computational Chemistry
|
August 27, 2010
Incorporation of deMon2k as a new parallel quantum mechanical code for the PUPIL system
Oscar Bertran, S B Trickey, Juan Torras
Journal of Chemical Theory and Computation
|
September 20, 2016
Multiscale Treatment for the Molecular Mechanism of a Diels-Alder Reaction in Solution: A QM/MM-MD Study
Jorge Soto-Delgado, Ricardo A Tapia, Juan Torras
Page
of 9