Browsing by Author Rovira i Virgili, Carme
Showing results 9 to 23 of 23
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| Issue Date | Title | Author(s) |
|---|---|---|
| 1-Nov-2016 | Desxifrant mecanismes enzimàtics per mitjà d'eines computacionals: implicacions biotecnològiques en l'estudi de glicosidases | Raich Armendáriz, Lluís Adrià; Rovira i Virgili, Carme |
| 11-Dec-2000 | Do Thiols Merely Passivate Gold Nanoclusters? | Garzón, I.; Rovira i Virgili, Carme; Michaelian, K.; Beltrán, M. R.; Ordejón, Pablo; Junquera, J.; Sánchez Portal, D.; Artacho, E.; Soler, J. M. |
| 19-Sep-2014 | Elucidating catalytic mechanisms of glycoside hydrolases and transferases by means of ab initio molecular dynamics simulations | Iglesias Fernández, Javier |
| 9-Dec-2013 | Enantioselective preparation of delta-valerolactones using horse liver alcohol dehydrogenase | Díaz-Rodríguez, Alba; Iglesias-Fernández, Javier; Rovira i Virgili, Carme; Gotor-Fernández, Vicente |
| 1-Jan-1996 | Estudi teòric d'interaccions intermoleculars en sistemes senzills i cristalls orgànics moleculars | Rovira i Virgili, Carme |
| 2002 | First-principles study of the neutral molecular metal Ni(tmdt)2. | Rovira i Virgili, Carme; Novoa Vide, Juan J.; Mozos Liz, José Luis de los; Ordejón, Pablo; Canadell, Enric, 1950- |
| 7-Nov-2007 | Mecanismes de preactivació de substrat en 1,3-1,4-beta-glucanasa. Modelització mitjançant dinàmica molecular de primers principis | Biarnés Fontal, Xavier |
| 20-Jan-2021 | Mechanistic insights into substrate-assisted catalysis in glycosidases by means of QM/MM molecular dynamics | Coines Lopez-Nieto, Juan |
| Jan-2022 | Neuraminidase superfamily compendium | Recio Sierra, Alba |
| 19-Nov-2022 | Phosphorylation disrupts long-distance electron transport in cytochrome c | Gomila, Alexandre M. J.; Pérez-Mejías, Gonzalo; Nin-Hill, Alba; Guerra-Castellano, Alejandra; Casas-Ferrer, Laura; Ortiz Tescari, Sthefany; Díaz Quintana, Antonio; Samitier i Martí, Josep; Rovira i Virgili, Carme; De la Rosa, Miguel A.; Díaz Moreno, Irene; Gorostiza, Pau; Giannotti, Marina I.; Lagunas, Anna |
| 2-Feb-2018 | Redesigning the coumarin scaffold into small bright fluorophores with far-red to NIR emission and large Stokes' shifts useful for cell imaging | Gandioso, Albert; Bresolí-Obach, Roger; Nin-Hill, Alba; Bosch, Manel; Palau Requena, Marta; Galindo Muñoz, Alex; Contreras, Sara; Rovira, Anna; Rovira i Virgili, Carme; Nonell, Santi; Marchán Sancho, Vicente |
| 2016 | Selective derivatization of N-terminal cysteines using cyclopentenediones | Brun Cubero, Omar; Agramunt, Jordi; Raich Armendáriz, Lluís Adrià; Rovira i Virgili, Carme; Pedroso Muller, Enrique; Grandas Sagarra, Anna |
| Jul-2017 | Sequential uncaging with green light can be achieved by fine-tuning the structure of a dicyanocoumarin chromophore | Gandioso, Albert; Palau Requena, Marta; Nin-Hill, Alba; Melnyk, Ivanna; Rovira i Virgili, Carme; Nonell, Santi; Velasco Castrillo, Dolores; Garcia Amorós, Jaume; Marchán Sancho, Vicente |
| 14-Jan-2021 | Two distinct catalytic pathways for GH43 xylanolytic enzymes unveiled by X-ray and QM/MM simulations | Morais, Mariana A. B.; Coines, Joan; Domingues, Mariane N.; Pirolla, Renan A. S.; Tonoli, Celisa C. C.; Santos, Camila R.; Correa, Jessica B. L.; Gozzo, Fabio C.; Rovira i Virgili, Carme; Murakami, Mario T. |
| 14-Jun-2018 | Unveiling Protein-Substrate Interactions and Conformations that Influence Catalysis in Carbohydrate-Active Enzymes | Raich Armendáriz, Lluís Adrià |