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Issue Date | Title | Author(s) |
---|---|---|
22-Nov-2021 | Discovery of diverse natural products as inhibitors of SARS-CoV-2 Mpro protease through virtual screening | Rubio Martínez, Jaime; Jiménez-Alesanco, Ana; Ceballos-Laita, Laura; Ortega Alarcón, David; Vega, Sonia; Calvo, Cristina; Benítez, Cristina; Abian, Olga; Velázquez-Campoy, Adrián; Thomson, Timothy; Granadino Roldán, José M.; Gómez-Gutiérrez, Patricia; Pérez González, Juan J. |
10-Jun-2022 | Adsorption of flexible proteins in the 'wrong side' of the isoelectric point: Casein macropeptide as a model system | Blanco Andrés, Pablo M.; Achetoni, Micaela M.; Garcés, Josep Lluís; Madurga Díez, Sergio; Mas i Pujadas, Francesc; Baieli, María F.; Narambuena, Claudio F. F. |
2022 | Quantifying interactions on interfaces between metal partic¬les and oxide supports in catalytic nanomaterials | Neyman, Konstantin M.; Kozlov, Sergey |
1-Jan-2020 | Multigram scale synthesis of polycyclic lactones and evaluation of antitumor and other biological properties | Grau, Laura; Romero, Manel; Privat-Contreras, Cristian; Presa, Daniela; Viñas, Miquel; Morral, Jordi; Pors, Klaus; Rubio Martínez, Jaime; Pujol Dilmé, M. Dolors |
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 |
24-Nov-2021 | Vibrational energy relaxation of a diatomic molecule in a superfluid helium nanodroplet: influence of the nanodroplet size, interaction energy and energy gap | Blancafort Jorquera, Miquel; González Pérez, Miguel |
19-Feb-2021 | Ultrafast resonant interatomic coulombic decay induced by quantum fluid dynamics | LaForge, A. C.; Michiels, R.; Ovcharenko, Y.; Ngai, A.; Escartín Esteban, José María; Berrah, N.; Callegari, C.; Clark, A.; Coreno, M.; Cucini, R.; Di Fraia, M.; Drabbels, M.; Fasshauer, E.; Finetti, P.; Giannessi, L.; Grazioli, C.; Iablonskyi, D.; Langbehn, B.; Nishiyama, T.; Oliver, V.; Piseri, P.; Plekan, O.; Prince, K. C.; Rupp, D.; Stranges, S.; Ueda, K.; Sisourat, N.; Eloranta, J.; Pi Pericay, Martí; Barranco Gómez, Manuel; Stienkemeier, F.; Möller, T.; Mudrich, M. |
26-May-2020 | A Semiempirical Method to Detect and Correct DFT-Based Gas-Phase Errors and Its Application in Electrocatalysis | Granda Marulanda, Laura P.; Rendón Calle, Alejandra; Builes, Santiago; Illas i Riera, Francesc; Koper, Marc T. M.; Calle Vallejo, Federico |
16-Nov-2022 | Playing catch and release with single molecules: mechanistic insights into plasmon-controlled nanogaps | Domke, Katrin F.; Aragonès, Albert C. |
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 |
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