Mariona Sodupe

According to our database, Mariona Sodupe authored at least 4 papers between 2009 and 2021.

Collaborative distances:

• Dijkstra number of six.
• Erdős number of six.

2021

First-Principles Modeling of Protein/Surface Interactions. Polyglycine Secondary Structure Adsorption on the TiO2 (101) Anatase Surface Adopting a Full Periodic Approach.

Stefano Pantaleone, Albert Rimola, Piero Ugliengo, Mariona Sodupe

J. Chem. Inf. Model., 2021

2020

Formamide Dehydration and Condensation on Acidic Montmorillonite: Mechanistic Insights from Ab-Initio Periodic Simulations.

Stefano Pantaleone, Albert Rimola, Javier Navarro-Ruiz, Pierre Mignon, Mariona Sodupe, Piero Ugliengo, Nadia Balucani

Proceedings of the Computational Science and Its Applications - ICCSA 2020, 2020

2011

In silico strategies for the selection of chelating compounds with potential application in metal-promoted neurodegenerative diseases.

Cristina Rodríguez-Rodríguez, Albert Rimola, Jorge Alí-Torres, Mariona Sodupe, Pilar González-Duarte

J. Comput. Aided Mol. Des., 2011

2009

Influence of ionization on the conformational preferences of peptide models. Ramachandran surfaces of <i>N</i>-formyl-glycine amide and <i>N</i>-formyl-alanine amide radical cations.

Adrià Gil, Mariona Sodupe, Juan Bertrán

J. Comput. Chem., 2009