ENPDA: an evolutionary structure-based de novo peptide design algorithm. - Ignasi Belda; Sergio Madurga; Xavier Llorà; Marc Martinell; Teresa Tarragó; Mireia G. Piqueras; Ernesto Nicolás; Ernest Giralt (J. Comput. Aided Mol. Des., 2005)

Peptide data mining: from virtual design to knowledge extraction. - Ignasi Belda; Ivan Traus; Susana Gordo; Teresa Tarragó; Sergio Madurga; Xavier Llorà; Ernest Giralt (GECCO, 2006)

Brownian Dynamics Computational Model of Protein Diffusion in Crowded Media with Dextran Macromolecules as Obstacles. - Pablo M. Blanco; Mireia Via; Josep Lluís Garcés; Sergio Madurga; Francesc Mas (Entropy, 2017)

Calculating the Partition Coefficients of Organic Solvents in Octanol/Water and Octanol/Air. - Miroslava Nedyalkova; Sergio Madurga; Marek Tobiszewski; Vasil Simeonov (J. Chem. Inf. Model., 2019)

Prediction of Partition Coefficients in SDS Micelles by DFT Calculations. - Leila Saranjam; Elisabet Fuguet; Miroslava Nedyalkova; Vasil Simeonov; Francesc Mas; Sergio Madurga (Symmetry, 2021)