Pablo Jaque

Affiliations

Departamento de Química Orgánica y Fisicoquímica, Facultad de Ciencias Químicas y Farmacéuticas, Universidad de Chile, Sergio Livingstone 1007, Santiago, Chile.

Publications (14)

Further understanding of the Ru-centered [2+2] cycloreversion/cycloaddition involved into the interconversion of ruthenacyclobutane using the Grubbs catalysts from a reaction force analysis.

Journal of molecular modeling

Avec: Katherine Paredes-Gil , Fernando Mendizábal , Pablo Jaque

Unusual Oxidative Dealkylation Strategy toward Functionalized Phenalenones as Singlet Oxygen Photosensitizers and Photophysical Studies.

The Journal of organic chemistry

Avec: Paul De Bonfils , Elise Verron , Catalina Sandoval-Altamirano , Pablo Jaque , Xavier Moreau , German Gunther , Pierrick Nun , Vincent Coeffard

Elucidating sensing mechanisms of a pyrene excimer-based calix[4]arene for ratiometric detection of Hg(ii) and Ag(i) and chemosensor behaviour as INHIBITION or IMPLICATION logic gates.

RSC advances

Avec: Julio Rodríguez-Lavado , Alejandro Lorente , Erick Flores , Andrés Ochoa , Fernando Godoy , Pablo Jaque , Claudio Saitz

Connection between nuclear and electronic Fukui functions beyond frontier molecular orbitals.

The Journal of chemical physics

Avec: Javier Oller , Pablo Jaque

1,3-Dipolar Cycloadditions by a Unified Perspective Based on Conceptual and Thermodynamics Models of Chemical Reactivity.

The journal of physical chemistry. A

Avec: César Barrales-Martínez , Jorge I Martínez-Araya , Pablo Jaque

Reaction force constant as a descriptor of the principle of non-perfect synchronization.

Journal of molecular modeling

Avec: César Barrales-Martínez , Danilo J Carmona , Javier Oller , Andrés F Flor-Lopez , Kevin Urrutia-Fernández , Sebastián Richter , Agustín Albornoz , Jorge Martínez-Araya , Pablo Jaque

Scrutinizing the substituent effect on Mo-based electrocatalysts for molecular hydrogen release through axial-equatorial decomposition: a DFT study.

Physical chemistry chemical physics : PCCP

Avec: Diana Yepes , Pablo Jaque , Jorge I Martínez-Araya

Effect of the exchange-correlation functional on the synchronicity/nonsynchronicity in bond formation in Diels-Alder reactions: a reaction force constant analysis.

Physical chemistry chemical physics : PCCP

Avec: Diana Yepes , Joel Valenzuela , Jorge I Martínez-Araya , Patricia Pérez , Pablo Jaque

Transition from synchronous to asynchronous mechanisms in 1,3-dipolar cycloadditions: a polarizability perspective.

Journal of molecular modeling

Avec: César Barrales-Martínez , Rocío Durán , Pablo Jaque

Synthesis, in vitro evaluation and molecular docking of a new class of indolylpropyl benzamidopiperazines as dual AChE and SERT ligands for Alzheimer's disease.

European journal of medicinal chemistry

Avec: Julio Rodríguez-Lavado , Carlos Gallardo-Garrido , Michael Mallea , Victor Bustos , Rodrigo Osorio , Martín Hödar-Salazar , Hery Chung , Ramiro Araya-Maturana , Marcos Lorca , C David Pessoa-Mahana , Jaime Mella-Raipán , Claudio Saitz , Pablo Jaque , Miguel Reyes-Parada , Patricio Iturriaga-Vásquez , Hernán Pessoa-Mahana

Real-Space Approach to the Reaction Force: Understanding the Origin of Synchronicity/Nonsynchronicity in Multibond Chemical Reactions.

The journal of physical chemistry. A

Avec: Diana Yepes , Julen Munarriz , Daniel l'Anson , Julia Contreras-Garcia , Pablo Jaque

5-HT

Journal of chemical information and modeling

Avec: Angélica Fierro , Douglas J Matthies , Bruce K Cassels , Pablo Jaque , Gerald Zapata-Torres

A deeper analysis of the role of synchronicity on the Bell-Evans-Polanyi plot in multibond chemical reactions: a path-dependent reaction force constant.

Physical chemistry chemical physics : PCCP

Avec: César Barrales-Martínez , Pablo Jaque

New insights into H

Chemical science

Avec: César Barrales-Martínez , Rocío Durán , Pablo Jaque

Réseau de co-auteurs

César Barrales-Martínez 5 collaborations

Jorge I Martínez-Araya 3 collaborations

Diana Yepes 3 collaborations

Julio Rodríguez-Lavado 2 collaborations

Claudio Saitz 2 collaborations

Javier Oller 2 collaborations

Rocío Durán 2 collaborations

Katherine Paredes-Gil 1 collaboration

Fernando Mendizábal 1 collaboration

Paul De Bonfils 1 collaboration

Elise Verron 1 collaboration

Catalina Sandoval-Altamirano 1 collaboration

Xavier Moreau 1 collaboration

German Gunther 1 collaboration

Pierrick Nun 1 collaboration

Vincent Coeffard 1 collaboration

Alejandro Lorente 1 collaboration

Erick Flores 1 collaboration

Andrés Ochoa 1 collaboration

Fernando Godoy 1 collaboration

Danilo J Carmona 1 collaboration

Andrés F Flor-Lopez 1 collaboration

Kevin Urrutia-Fernández 1 collaboration

Sebastián Richter 1 collaboration

Agustín Albornoz 1 collaboration

Jorge Martínez-Araya 1 collaboration

Joel Valenzuela 1 collaboration

Patricia Pérez 1 collaboration

Carlos Gallardo-Garrido 1 collaboration

Michael Mallea 1 collaboration

Victor Bustos 1 collaboration

Rodrigo Osorio 1 collaboration

Martín Hödar-Salazar 1 collaboration

Hery Chung 1 collaboration

Ramiro Araya-Maturana 1 collaboration

Marcos Lorca 1 collaboration

C David Pessoa-Mahana 1 collaboration

Jaime Mella-Raipán 1 collaboration

Miguel Reyes-Parada 1 collaboration

Patricio Iturriaga-Vásquez 1 collaboration

Hernán Pessoa-Mahana 1 collaboration

Julen Munarriz 1 collaboration

None Daniel l'Anson 1 collaboration

Julia Contreras-Garcia 1 collaboration

Angélica Fierro 1 collaboration

Douglas J Matthies 1 collaboration

Bruce K Cassels 1 collaboration

Gerald Zapata-Torres 1 collaboration