Browse
Collection's Items (Sorted by Submit Date in Descending order): 21 to 40 of 158
| Issue Date | Title | Author(s) |
|---|---|---|
| 25-May-2023 | A Step forward toward selective activation/inhibition of Bak, a pro-apoptotic member of the Bcl-2 protein family: discovery of new prospective allosteric sites using molecular dynamics | Vila-Julia, Guillem; Perez, Juan J.; Rubio Martínez, Jaime |
| 2011 | Dimer-covering resonating-valence-bond treatment of single-walled zigzag carbon nanotubes | García Bach, Ma. de los Ángeles |
| 14-Sep-2022 | The template effect of a SiF62- guest drives the formation of a heteroleptic Fe(II) coordination helicate | Capó, Nuria; Barrios Moreno, Leoní Alejandra; Cardona, Joan; Ribas Ariño, Jordi; Teat, Simon J.; Roubeau, Olivier; Aromí Bedmar, Guillem |
| 13-Apr-2023 | Autochthonous peruvian natural plants as potential SARS-CoV-2 Mpro main protease inhibitors | Peralta Moreno, María Nuria; Anton-Muñoz, Vanessa; Ortega-Alarcon, David; Jimenez-Alesanco, Ana; Vega, Sonia; Abian, Olga; Velazquez-Campoy, Adrian; Thomson, Timothy M.; Granadino-Roldán, José Manuel; Machicado, Claudia; Rubio Martinez, Jaime |
| 14-Feb-2023 | Theoretical Analysis of Magnetic Coupling in the Ti2C Bare MXene | García-Romeral, Néstor; Morales-García, Ángel; Viñes Solana, Francesc; Moreira, Ibério de Pinho Ribeiro; Illas i Riera, Francesc |
| 6-Mar-2023 | States of Pt/CeO2 catalysts for CO oxidation below room temperature. | Slavinskaya, Elena M.; Stadnichenko, Andrey I.; Quinlivan Domínguez, Jon E.; Stonkus, Olga A.; Vorokhta, M.; míd, Břetislav; Castro-Latorre, Pablo; Bruix, Albert; Neyman, Konstantin M.; Boronin, Andrei I. |
| 6-Apr-2022 | Challenges of modeling nanostructured materials for photocatalytic water splitting | Samanta, Bipasa; Morales García, Ángel; Illas i Riera, Francesc; Goga, Nicolae; Anta, Juan Antonio; Calero, Sofia; Beberle-Hütter, Anja; Libisch, Florian; Muñoz-García, Ana B.; Pavone, Michele; Caspary Toroker, Maytal |
| 17-Jan-2023 | A Catastrophe Theory Based Model for Optimal Control of Chemical Reactions by means of Oriented Electric Fields | Bofill i Villà, Josep M.; Quapp, Wolfgang; Moreira, Ibério de Pinho Ribeiro; Ribas Ariño, Jordi; Severi, Marco; Albareda, Guillermo |
| 25-May-2022 | A generalized Frenkel-Kontorova model for a propagating austenite-martensite phase boundary: revisited numerically | Quapp, Wolfgang; Bofill i Villà, Josep M. |
| 1-May-2022 | In flow-based technologies: A new paradigm for the synthesis and processing of covalent-organic frameworks | Martinez-Bulit, Pablo; Sorrenti, Alessandro; Rodriguez San Miguel, David; Mattera, Michelle; Belce, Yonca; Xia, Yanming; Ma, Shenglin; Huang, Mu-Hua; Pané, Salvador; Puigmartí-Luis, Josep |
| 6-Oct-2022 | Cluster Beam Study of (MgSiO3)+-Based Monomeric Silicate Species and Their Interaction with Oxygen: Implications for Interstellar Astrochemistry | Mariñoso Guiu, Joan; Ghejan, Bianca Andreea; Bernhardt, Thorsten M.; Bakker, Joost M.; Lang, Sandra M.; Bromley, Stefan Thomas |
| 22-Jun-2022 | X‐ray Detectors With Ultrahigh Sensitivity Employing High Performance Transistors Based on a Fully Organic Small Molecule Semiconductor/Polymer Blend Active Layer | Tamayo, Adrián; Fratelli, Ilaria; Ciavatti, Andrea; Martínez Domingo, Carme; Branchini, Paolo; Colantoni, Elisabetta; Rosa, Stefania de; Tortora, Luca; Contillo, Adriano; Santiago, Raúl; Bromley, Stefan Thomas; Fraboni, Beatrice; Mas Torrent, Marta; Basiricò, Laura |
| 27-Jul-2022 | Efficient Routes for the Preparation of Urazole Radical Self-Assembled Monolayers on Gold Surfaces | Campos Lendinez, Ángel; Crivillers, Núria; Bromley, Stefan Thomas; Rovira, Concepció; Breton, Gary W.; Mas Torrent, Marta |
| 18-Jun-2022 | Effect of nanostructuring on the interaction of CO2 with molybdenum carbide nanoparticles | Jiménez-Orozco, Carlos; Figueras, Marc; Flórez, Elizabeth; Viñes Solana, Francesc; Rodriguez, José A.; Illas i Riera, Francesc |
| 15-Jul-2022 | Charting the Atomic C Interaction with Transition Metal Surfaces | Piqué, Oriol; Koleva, Iskra Z.; Bruix, Albert; Viñes Solana, Francesc; Aleksandrov, Hristiyan A.; Vayssilov, Georgi N.; Illas i Riera, Francesc |
| 15-Mar-2022 | Effect of oxygen termination on the interaction of first row transition metals with M2C MXenes and the feasibility of single-atom catalysts | Keyhanian, Masoomeh; Farmanzadeh, David; Morales García, Ángel; Illas i Riera, Francesc |
| 11-Aug-2022 | Carbon-doped anatase titania nanoparticles: similarities and differences with respect to bulk and extended surface models | Remesal, Elena R.; Morales García, Ángel |
| 4-Mar-2022 | Effect of the sulfur termination on the properties of Hf2CO2 MXene | Ougherb, Chewki; Ouahrani, Tarik; Badawi, Michael; Morales García, Ángel |
| 6-Feb-2022 | Theoretical calculations of the effect of nitrogen substitution on the structural, vibrational, and electronic properties of wolframite-type ScTaO4 at ambient conditions | Karaouzène, Lotfi I.; Ouahrani, Tarik; Morales García, Ángel; Errandonea, Daniel |
| 17-Feb-2021 | Combinatorial k-means clustering as a machine learning tool applied to diabetes mellitus type 2 | Nedyalkova, Miroslava; Madurga Díez, Sergio; Simeonov, Vasil |
Collection's Items (Sorted by Submit Date in Descending order): 21 to 40 of 158