Zobrazeno 1 - 10
of 146
pro vyhledávání: '"Laurent Joubert"'
Autor:
Sébastien Menant, Frédéric Guégan, Vincent Tognetti, Lynda Merzoud, Laurent Joubert, Henry Chermette, Christophe Morell
Publikováno v:
Molecules, Vol 26, Iss 20, p 6218 (2021)
Electronic effects (inductive and mesomeric) are of fundamental importance to understand the reactivity and selectivity of a molecule. In this article, polarisation temperature is used as a principal index to describe how electronic effects propagate
Externí odkaz:
https://doaj.org/article/9209f730009a465492ff0311739e5f87
Autor:
Ricardo Almada-Monter, Omar A. Álvarez-Gonzaga, James S.M. Anderson, Paul W. Ayers, José E. Barquera-Lozada, Yoshio Barrera, Giovanna Bruno, Pablo Carpio-Martínez, Julia Contreras-García, Fernando Cortés-Guzmán, Aurora Costales, Emiliano Dorantes-Hernández, Mark E. Eberhart, Alberto Fernández-Alarcón, Evelio Francisco, Marco Antonio Garcia-Revilla, Carlo Gatti, Rosa M. Gómez-Espinosa, José M. Guevara-Vela, Jesús Hernández-Trujillo, Jesús Jara-Cortés, Samantha Jenkins, Laurent Joubert, Airi Kawasaki, Steven R. Kirk, Bruno Landeros-Rivera, Chérif F. Matta, Héctor D. Morales-Rodríguez, Amanda Morgenstern, Aldo de Jesús Mortera-Carbonell, Xing Nie, Eduardo Orozco-Valdespino, Ángel Martín Pendás, David I. Ramírez-Palma, Tomás Rocha-Rinza, Juan I. Rodríguez, Shant Shahbazian, David C. Thompson, Vincent Tognetti, Ismael Vargas-Rodríguez, Timothy R. Wilson, Tianlv Xu, Yong Yang
Publikováno v:
Advances in Quantum Chemical Topology Beyond QTAIM ISBN: 9780323908917
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::8a6a5fbceb6d5d85ceacaebaa187cc9c
https://doi.org/10.1016/b978-0-323-90891-7.09992-8
https://doi.org/10.1016/b978-0-323-90891-7.09992-8
Autor:
Vincent Tognetti, Laurent Joubert
Publikováno v:
Advances in Quantum Chemical Topology Beyond QTAIM ISBN: 9780323908917
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::dae17cb7a6c18fe686df5186ad5f6f00
https://doi.org/10.1016/b978-0-323-90891-7.00001-3
https://doi.org/10.1016/b978-0-323-90891-7.00001-3
Autor:
Éric Brémond, Vincent Tognetti, Henry Chermette, Juan Carlos Sancho-García, Laurent Joubert, Carlo Adamo
Publikováno v:
RUA. Repositorio Institucional de la Universidad de Alicante
Universidad de Alicante (UA)
Universidad de Alicante (UA)
We investigate the relationships between electron-density and electronic-energy errors produced by modern exchange-correlation density-functional approximations belonging to all of the rungs of Perdew’s ladder. To this aim, a panel of relevant (sem
Publikováno v:
Theoretical Chemistry Accounts. 141
Autor:
Alexis Lossouarn, Chloé Puteaux, Laetitia Bailly, Vincent Tognetti, Laurent Joubert, Pierre‐Yves Renard, Cyrille Sabot
Publikováno v:
Chemistry – A European Journal. 28
Proteins are able to irreversibly assemble biologically active ligands from building blocks bearing complementary reactive functions due their spatial proximity, through a kinetic target-guided synthetic process (also named in situ click chemistry).
Autor:
Pauline Priol, Fabien Mignet, Florine Escot, Laurent Barthe, Jean-Yves Barnagaud, Laurent Joubert, Kathleen Perrot, Jérémiah Petit, Valérie Bosc, Romain Fleuriau, Anthony Olivier, Grégoire Massez, Françoise Poitevin, Olivier Scher, Marc Cheylan, Damien Lerat, Vincent Rivière, Albert Bertolero, Stephanie Thienpont, Zoey Owen-Jones, André Joyeux, Cédric Roy, Laetitia Poulet, Timothée Schwartz, Jean-Marc Thirion, Benjamin Vollot
Publikováno v:
Amphibia-Reptilia. 42:141-151
The processes underlying macroecological gradients in body size are widely debated, in part because their intraspecific variability remains poorly described even in well-studied taxa such as vertebrates. In this study, we investigated how climate, ha
Autor:
Sébastien Adam, Guillaume Hoffmann, Muhammet Balcilar, Benoit Gaüzère, Vincent Tognetti, Laurent Joubert, Pierre Héroux
Publikováno v:
Journal of Computational Chemistry. 41:2124-2136
Autor:
Christophe Morell, Frédéric Guégan, Laurent Joubert, Sébastien Menant, Vincent Tognetti, Henry Chermette, Lynda Merzoud
Publikováno v:
Molecules
Volume 26
Issue 20
Molecules, Vol 26, Iss 6218, p 6218 (2021)
Molecules, MDPI, 2021, 26 (20), pp.6218. ⟨10.3390/molecules26206218⟩
Volume 26
Issue 20
Molecules, Vol 26, Iss 6218, p 6218 (2021)
Molecules, MDPI, 2021, 26 (20), pp.6218. ⟨10.3390/molecules26206218⟩
International audience; Electronic effects (inductive and mesomeric) are of fundamental importance to understand the reactivity and selectivity of a molecule. In this article, polarisation temperature is used as a principal index to describe how elec
Publikováno v:
Electronics. 11:3312
Graph edit distance (GED) is a powerful tool to model the dissimilarity between graphs. However, evaluating the exact GED is NP-hard. To tackle this problem, estimation methods of GED were introduced, e.g., bipartite and IPFP, during which heuristics