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1

Angular momentum–scattering angle quantum correlation: A generalized deflection function

Jambrina, Pablo G, Menendez, Marta, Aoiz, Francois Javier

Journal:

Chemical Science

Year:

2018

Language:

english

File:

PDF, 3.35 MB

english, 2018

2

Stereodynamical Control of a Quantum Scattering Resonance in Cold Molecular Collisions

Jambrina, Pablo G., Croft, James F. E., Guo, Hua, Brouard, Mark, Balakrishnan, Naduvalath, Aoiz, F. Javier

Journal:

Physical Review Letters

Year:

2019

Language:

english

File:

PDF, 808 KB

english, 2019

3

Pre-service Teachersâ False Beliefs in Superstitions and Pseudosciences in Relation to Science and Technology

Fuertes-Prieto, Miguel Ãngel, AndrÃ©s-SÃ¡nchez, Santiago, Corrochano-FernÃ¡ndez, Diego, Urones-Jambrina, Carmen, Delgado-MartÃn, MÂª Laura, Herrero-TeijÃ³n, Pablo, Ruiz, Camilo

Journal:

Science & Education

Year:

2020

File:

PDF, 1.10 MB

2020

4

A ring polymer molecular dynamics study of the isotopologues of the H + H2 reaction

Suleimanov, Yury V., de Tudela, Ricardo Pérez, Jambrina, Pablo G., Castillo, Jesús F., Sáez-Rábanos, Vicente, Manolopoulos, David E., Aoiz, F. Javier

Journal:

Physical Chemistry Chemical Physics

Year:

2013

Language:

english

File:

PDF, 860 KB

english, 2013

5

Exploring the role of the 5-substituent for the intrinsic fluorescence of 5-aryl and 5-heteroaryl uracil nucleotides: a systematic study

Pesnot, Thomas, Tedaldi, Lauren M., Jambrina, Pablo G., Rosta, Edina, Wagner, Gerd K.

Journal:

Organic & Biomolecular Chemistry

Year:

2013

Language:

english

File:

PDF, 1.32 MB

english, 2013

6

New findings regarding the NO angular momentum orientation in Ar–NO(2Π1/2) collisions

Jambrina, Pablo G., Kłos, Jacek, Aoiz, F. Javier, de Miranda, Marcelo P.

Journal:

Physical Chemistry Chemical Physics

Year:

2012

Language:

english

File:

PDF, 2.94 MB

english, 2012

7

A state-to-state dynamical study of the Br + H2 reaction: comparison of quantum and classical trajectory results

Panda, Aditya N., Herráez-Aguilar, Diego, Jambrina, Pablo G., Aldegunde, Jesús, Althorpe, Stuart C., Aoiz, F. Javier

Journal:

Physical Chemistry Chemical Physics

Year:

2012

Language:

english

File:

PDF, 2.72 MB

english, 2012

8

Stereodynamics of the F + HD(v = 0, j = 1) reaction: direct vs. resonant mechanisms

Aldegunde, Jesús, Jambrina, Pablo G., de Miranda, Marcelo P., Rábanos, Vicente Sáez, Aoiz, F. Javier

Journal:

Physical Chemistry Chemical Physics

Year:

2011

Language:

english

File:

PDF, 3.78 MB

english, 2011

9

Communications: When diffraction rules the stereodynamics of rotationally inelastic collisions

Lemeshko, Mikhail, Jambrina, Pablo G., de Miranda, Marcelo P., Friedrich, Bretislav

Journal:

The Journal of Chemical Physics

Year:

2010

Language:

english

File:

PDF, 582 KB

english, 2010

10

Molecular mechanisms of asymmetric RAF dimer activation

Jambrina, Pablo G., Bohuszewicz, Olga, Buchete, Nicolae‑Viorel, Kolch, Walter, Rosta, Edina

Journal:

Biochemical Society Transactions

Year:

2014

Language:

english

File:

PDF, 987 KB

english, 2014

11

Direct Evidence for a Peroxide Intermediate and a Reactive Enzyme-Substrate-Dioxygen Configuration in a Cofactor-free Oxidase

Bui, Soi, von Stetten, David, Jambrina, Pablo G., Prangé, Thierry, Colloc'h, Nathalie, de Sanctis, Daniele, Royant, Antoine, Rosta, Edina, Steiner, Roberto A.

Journal:

Angewandte Chemie International Edition

Year:

2014

Language:

english

File:

PDF, 1.99 MB

english, 2014

12

Influence of the previous use of β-blockers on the early clinical course of acute coronary syndromes

Garcia-Rubira, Juan Carlos, Almendro-Delia, Manuel, Calvo-Taracido, Manuel, Blanco-Ponce, Emilia, Bastos-Amador, Pablo, Reina-Toral, Antonio, Calvo-Jambrina, Roman, Cruz-Fernández, José Maria, Garcia-

Journal:

Internal and Emergency Medicine

Year:

2015

Language:

english

File:

PDF, 552 KB

english, 2015

13

Mutations Decouple Proton Transfer from Phosphate Cleavage in the dUTPase Catalytic Reaction

Lopata, Anna, Jambrina, Pablo G., Sharma, Pankaz K., Brooks, Bernard R., Toth, Judit, Vertessy, Beata G., Rosta, Edina

Journal:

Year:

2015

Language:

english

File:

PDF, 5.65 MB

english, 2015

14

Quantum interference between H + D2 quasiclassical reaction mechanisms

Jambrina, Pablo G., Herráez-Aguilar, Diego, Aoiz, F. Javier, Sneha, Mahima, Jankunas, Justinas, Zare, Richard N.

Journal:

Nature Chemistry

Year:

2015

Language:

english

File:

PDF, 687 KB

english, 2015

15

Communication: Rate coefficients from quasiclassical trajectory calculations from the reverse reaction: The Mu + H2 reaction re-visited

Homayoon, Zahra, Jambrina, Pablo G., Aoiz, F. Javier, Bowman, Joel M.

Journal:

The Journal of Chemical Physics

Year:

2012

Language:

english

File:

PDF, 205 KB

english, 2012

16

Light-regulated Molecular Trafficking in a Synthetic Water-soluble Host

del Barrio, Jesús, Ryan, Sean T. J., Jambrina, Pablo G., Rosta, Edina, Scherman, Oren A

Journal:

Journal of the American Chemical Society

Year:

2016

Language:

english

File:

PDF, 1.89 MB

english, 2016

17

Divergence from the classical hydroboration reactivity; boron containing materials through a hydroboration cascade of small cyclic dienes

Andreou, Anna, Leskes, Michal, Jambrina, Pablo G., Tustin, Gary J., Grey, Clare P., Rosta, Edina, Scherman, Oren A.

Journal:

Chemical Science

Year:

2015

Language:

english

File:

PDF, 857 KB

english, 2015

18

Phosphorylation of RAF Kinase Dimers Drives Conformational Changes that Facilitate Transactivation

Jambrina, Pablo G., Rauch, Nora, Pilkington, Ruth, Rybakova, Katja, Nguyen, Lan K., Kholodenko, Boris N., Buchete, Nicolae-Viorel, Kolch, Walter, Rosta, Edina

Journal:

Angewandte Chemie International Edition

Year:

2016

Language:

english

File:

PDF, 3.29 MB

english, 2016

19

Phosphorylation of RAF Kinase Dimers Drives Conformational Changes that Facilitate Transactivation

Jambrina, Pablo G., Rauch, Nora, Pilkington, Ruth, Rybakova, Katja, Nguyen, Lan K., Kholodenko, Boris N., Buchete, Nicolae-Viorel, Kolch, Walter, Rosta, Edina

Journal:

Angewandte Chemie

Year:

2016

Language:

english

File:

PDF, 3.26 MB

english, 2016

20

Direct Evidence for a Peroxide Intermediate and a Reactive Enzyme-Substrate-Dioxygen Configuration in a Cofactor-free Oxidase

Bui, Soi, von Stetten, David, Jambrina, Pablo G., Prangé, Thierry, Colloc'h, Nathalie, de Sanctis, Daniele, Royant, Antoine, Rosta, Edina, Steiner, Roberto A.

Journal:

Angewandte Chemie

Year:

2014

Language:

english

File:

PDF, 1.99 MB

english, 2014

21

Understanding the Mechanism of the Hydrogen Abstraction from Arachidonic Acid Catalyzed by the Human Enzyme 15-Lipoxygenase-2. A Quantum Mechanics/Molecular Mechanics Free Energy Simulation

Suardíaz, Reynier, Jambrina, Pablo G., Masgrau, Laura, González-Lafont, Àngels, Rosta, Edina, Lluch, José M.

Journal:

Journal of Chemical Theory and Computation

Year:

2016

Language:

english

File:

PDF, 1.60 MB

english, 2016

22

The dynamics of the Hg + Br2 reaction. Elucidation of the reaction mechanism for Br exchange reaction

Jambrina, Pablo G, Menendez, Marta, Aoiz, Francois Javier

Journal:

Physical Chemistry Chemical Physics

Year:

2017

Language:

english

File:

PDF, 8.76 MB

english, 2017

23

Insights into functions of the H channel of cytochrome c oxidase from atomistic molecular dynamics simulations

Sharma, Vivek, Jambrina, Pablo G., Kaukonen, Markus, Rosta, Edina, Rich, Peter R.

Journal:

Proceedings of the National Academy of Sciences

Year:

2017

Language:

english

File:

PDF, 1.70 MB

english, 2017

24

Λ-Doublet Propensities for reactions on competing A' and A'' potential energy surfaces: O( 3 P)+N 2 and O( 3 P)+HCl

G Jambrina, Pablo, Menendez, Marta, Zanchet, Alexandre, Garcia, Ernesto, Aoiz, F. Javier

Journal:

Journal of Physical Chemistry A

Year:

2018

Language:

english

File:

PDF, 996 KB

english, 2018

25

Non-intuitive rotational reorientation in collisions of NO(A 2Σ+) with Ne from direct measurement of a four-vector correlation

Sharples, Thomas R., Leng, Joseph G., Luxford, Thomas F. M., McKendrick, Kenneth. G., Jambrina, Pablo G., Aoiz, F. Javier, Chandler, David W., Costen, Matthew L.

Journal:

Nature Chemistry

Year:

2018

Language:

english

File:

PDF, 2.00 MB

english, 2018

26

Side-impact collisions of Ar with NO

Heid, Cornelia G., Walpole, Victoria, Brouard, Mark, Jambrina, Pablo G., Aoiz, F. Javier

Journal:

Nature Chemistry

Year:

2019

Language:

english

File:

PDF, 1.93 MB

english, 2019

27

Side-impact collisions of Ar with NO

Heid, Cornelia G., Walpole, Victoria, Brouard, Mark, Jambrina, Pablo G., Aoiz, F. Javier

Journal:

Nature Chemistry

Year:

2019

File:

PDF, 1.93 MB

2019

28

Kinetics of the H + CH 2 → CH + H 2 Reaction At Low Temperature

Garcia, Ernesto, Jambrina, Pablo G., Lagana, Antonio

Journal:

Journal of Physical Chemistry A

Year:

2019

Language:

english

File:

PDF, 2.54 MB

english, 2019

29

New Stress Test for Ring Polymer Molecular Dynamics: Rate Coefficients of the O( 3P )+HCl Reaction and Comparison with Quantum Mechanical and Quasiclassical Trajectory Results

Menendez, Marta, Jambrina, Pablo G., Zanchet, Alexandre, Verdasco, Enrique, Suleimanov, Yury V., Aoiz, F. Javier

Journal:

Journal of Physical Chemistry A

Year:

2019

Language:

english

File:

PDF, 1.02 MB

english, 2019

30

New global potential energy surfaces of the ground 3A ′ and 3A ″ states of the O( 3P ) + H 2 system

Zanchet, Alexandre, Menéndez, Marta, Jambrina, Pablo G., Aoiz, F. Javier

Journal:

The Journal of Chemical Physics

Year:

2019

Language:

english

File:

PDF, 4.62 MB

english, 2019

31

Steric Effects in the Inelastic Scattering of NO(X) + Ar: Side-on Orientation

Walpole, Victoria H, Heid, Cornelia G, Jambrina, Pablo G., Aoiz, F. Javier, Brouard, Mark

Journal:

Journal of Physical Chemistry A

Year:

2019

Language:

english

File:

PDF, 4.52 MB

english, 2019

32

Competing Dynamical Mechanisms in Inelastic Collisions of H+HF

Jambrina, Pablo G., González-Sánchez, Lola, Aldegunde, Jesus, Saez-Rabanos, Vicente, Aoiz, F. Javier

Journal:

Journal of Physical Chemistry A

Year:

2019

Language:

english

File:

PDF, 7.54 MB

english, 2019

33

New global potential energy surfaces of the ground 3A ′ and 3A ″ states of the O( 3P ) + H 2 system

Zanchet, Alexandre, Menéndez, Marta, Jambrina, Pablo G., Aoiz, F. Javier

Journal:

The Journal of Chemical Physics

Year:

2019

File:

PDF, 4.62 MB

2019

34

Steric Effects in the Inelastic Scattering of NO(X) + Ar: Side-on Orientation

Walpole, Victoria H, Heid, Cornelia G, Jambrina, Pablo G., Aoiz, F. Javier, Brouard, Mark

Journal:

Journal of Physical Chemistry A

Year:

2019

File:

PDF, 4.52 MB

2019

35

Antileishmanial activity of terpenylquinones on Leishmania infantum and their effects on Leishmania topoisomerase IB

Pérez-Pertejo, Yolanda, Escudero-Martínez, José M., Reguera, Rosa M., Balaña-Fouce, Rafael, García, Pablo A., Jambrina, Pablo G., San Feliciano, Arturo, Castro, María-Ángeles

Journal:

International Journal for Parasitology Drugs and Drug Resistance

Year:

2019

Language:

english

File:

PDF, 3.02 MB

english, 2019

36

Asymmetric [3+2] cycloaddition reaction of a chiral cyclic nitrone for the synthesis of new tropane alkaloids

Esteban, Alberto, Izquierdo, Ignacio, García, Nieves, Sexmero, María J., Garrido, Narciso M., Marcos, Isidro S., Sanz, Francisca, Jambrina, Pablo G., Ortega, Pablo, Diez, David

Journal:

Year:

2019

Language:

english

File:

PDF, 987 KB

english, 2019

37

Probing the location of the unpaired electron in spin-orbit changing collisions of NO with Ar

Heid, Cornelia G., Bentham, Imogen P., Walpole, Victoria, Gheorghe, Razvan, Jambrina, Pablo G., Aoiz, F. Javier, Brouard, Mark

Journal:

Physical Chemistry Chemical Physics

Year:

2020

File:

PDF, 2.09 MB

2020

38

A Novel Cytotoxic Conjugate Derived from the Natural Product Podophyllotoxin as a Direct-Target Protein Dual Inhibitor

HernÃ¡ndez, Ãngela-Patricia, DÃez, Paula, GarcÃa, Pablo A., PÃ©rez-AndrÃ©s, MartÃn, Ortega, Pablo, Jambrina, Pablo G., DÃez, David, Castro, MarÃa Ãngeles, Fuentes, Manuel

Journal:

Year:

2020

File:

PDF, 3.37 MB

2020

39

DpgCâcatalyzed peroxidation ofÂ DPAâCoA: insights into the spinâforbidden transition and charge transfer mechanisms

Ortega, Pablo, Zanchet, Alexandre, Sanz Sanz, Cristina, GÃ³mez Carrasco, Susana, GonzÃ¡lez SÃ¡nchez, Lola, Jambrina, Pablo G.

Journal:

Chemistry (Weinheim an der Bergstrasse, Germany)

Year:

2020

File:

PDF, 2.55 MB

2020

40

Differential cross sections and collision-induced rotational alignment in inelastic scattering of NO(X) by Xe

Brouard, Mark, Chadwick, Helen, Gordon, Sean D. S., Heid, Cornelia G., Hornung, Balazs, Nichols, Bethan, KÅos, Jacek, Jambrina, Pablo G., Aoiz, F. Javier

Journal:

Chinese Journal of Chemical Physics

Year:

2020

File:

PDF, 21.48 MB

2020

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