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The Journal of Chemical Physics
|
August 24, 2013
Electronic states of porphycene-O2 complex and photoinduced singlet O2 production
David Asturiol, Mario Barbatti
The Journal of Chemical Physics
|
April 17, 2008
Intramolecular basis set superposition error effects on the planarity of benzene and other aromatic molecules: a solution to the problem
David Asturiol, Miquel Duran, Pedro Salvador
Regulatory Toxicology and Pharmacology : RTP
|
January 7, 2023
Reduced specificity for the local lymph node assay for lipophilic chemicals: Implications for the validation of new approach methods for skin sensitization
Andreas Natsch, Nicole Kleinstreuer, David Asturiol
Chemphyschem : a European Journal of Chemical Physics and Physical Chemistry
|
May 26, 2009
Dissecting the hindered rotation of ethane
David Asturiol, Pedro Salvador, István Mayer
Regulatory Toxicology and Pharmacology : RTP
|
March 10, 2023
Reply to Comment on "Reduced specificity for the local lymph node assay for lipophilic chemicals: Implications for the validation of new approach methods for skin sensitization" by Roberts and Basketter
Andreas Natsch, Nicole Kleinstreuer, David Asturiol
Journal of Chemical Theory and Computation
|
December 1, 2015
Intramolecular Basis Set Superposition Error Effects on the Planarity of DNA and RNA Nucleobases
David Asturiol, Miquel Duran, Pedro Salvador
Alternatives to Laboratory Animals : ATLA
|
August 6, 2016
Exploring waiving opportunities for mammalian acute systemic toxicity tests
Rabea Graepel, David Asturiol, Pilar Prieto, et al.
The Journal of Physical Chemistry. A
|
September 3, 2009
Photophysics of the pi,pi* and n,pi* states of thymine: MS-CASPT2 minimum-energy paths and CASSCF on-the-fly dynamics
David Asturiol, Benjamin Lasorne, Michael A Robb, et al.
The Journal of Physical Chemistry. A
|
April 21, 2009
Benign decay vs. photolysis in the photophysics and photochemistry of 5-bromouracil. A computational study
Monika Kobyłecka, Annapaola Migani, David Asturiol, et al.
Physical Chemistry Chemical Physics : PCCP
|
May 7, 2010
Exploring the sloped-to-peaked S2/S1 seam of intersection of thymine with electronic structure and direct quantum dynamics calculations
David Asturiol, Benjamin Lasorne, Graham A Worth, et al.
Page
of 3
Search research articles
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Showing results (1-10 of 22) with videos related to
Sort By:
Page
of 3
The Journal of Chemical Physics
|
August 24, 2013
Electronic states of porphycene-O2 complex and photoinduced singlet O2 production
David Asturiol, Mario Barbatti
The Journal of Chemical Physics
|
April 17, 2008
Intramolecular basis set superposition error effects on the planarity of benzene and other aromatic molecules: a solution to the problem
David Asturiol, Miquel Duran, Pedro Salvador
Regulatory Toxicology and Pharmacology : RTP
|
January 7, 2023
Reduced specificity for the local lymph node assay for lipophilic chemicals: Implications for the validation of new approach methods for skin sensitization
Andreas Natsch, Nicole Kleinstreuer, David Asturiol
Chemphyschem : a European Journal of Chemical Physics and Physical Chemistry
|
May 26, 2009
Dissecting the hindered rotation of ethane
David Asturiol, Pedro Salvador, István Mayer
Regulatory Toxicology and Pharmacology : RTP
|
March 10, 2023
Reply to Comment on "Reduced specificity for the local lymph node assay for lipophilic chemicals: Implications for the validation of new approach methods for skin sensitization" by Roberts and Basketter
Andreas Natsch, Nicole Kleinstreuer, David Asturiol
Journal of Chemical Theory and Computation
|
December 1, 2015
Intramolecular Basis Set Superposition Error Effects on the Planarity of DNA and RNA Nucleobases
David Asturiol, Miquel Duran, Pedro Salvador
Alternatives to Laboratory Animals : ATLA
|
August 6, 2016
Exploring waiving opportunities for mammalian acute systemic toxicity tests
Rabea Graepel, David Asturiol, Pilar Prieto, et al.
The Journal of Physical Chemistry. A
|
September 3, 2009
Photophysics of the pi,pi* and n,pi* states of thymine: MS-CASPT2 minimum-energy paths and CASSCF on-the-fly dynamics
David Asturiol, Benjamin Lasorne, Michael A Robb, et al.
The Journal of Physical Chemistry. A
|
April 21, 2009
Benign decay vs. photolysis in the photophysics and photochemistry of 5-bromouracil. A computational study
Monika Kobyłecka, Annapaola Migani, David Asturiol, et al.
Physical Chemistry Chemical Physics : PCCP
|
May 7, 2010
Exploring the sloped-to-peaked S2/S1 seam of intersection of thymine with electronic structure and direct quantum dynamics calculations
David Asturiol, Benjamin Lasorne, Graham A Worth, et al.
Page
of 3