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Publications

2024

Exo-chirality of the α-helix
J.M. Martínez-Parra, R. Gómez-Ojea, G.A. Daudey, M. Calvelo, H. Fernández-Caro, J. Montenegro, J. Bergueiro

Recognition of anion-water clusters by peptide-based supramolecular capsules
V. López-Corbalán, A. Fuertes, A.L. Llamas-Saiz, M. Amorín, J.R. Granja

Stabilization of Non-Native Folds and Programmable Protein Gelation in Compositionally Designed Deep Eutectic Solvents
A. Sanchez-Fernandez, J.-F. Poon, A.E. Leung, S.F. Prévost, C. Dicko

Size and Polarizability of Boron Cluster Carriers Modulate Chaotropic Membrane Transport
G. Salluce, Y. Folgar-Cameán, A. Barba-Bon, I. Nikšić-Franjić, S. El Anwar, B. Grüner, I. Lostale-Seijo, W. Nau, J. Montenegro

CYCLOPEp Builder: Facilitating Cyclic Peptide and Nanotube Research through a User-Friendly Web Platform
A. Cabezón, F. Suárez-Lestón, J.R. Granja, Á. Piñeiro, R. Garcia-Fandino

Unraveling the molecular dynamics of sugammadex-rocuronium complexation: A blueprint for cyclodextrin drug design
A. Anderson*, Á. Piñeiro, R. García-Fandiño, M.S. O'Connor

Protocol for photo-controlling the assembly of cyclic peptide nanotubes in solution and inside microfluidic droplets
M. Vilela-Picos, F. Novelli, A. Méndez-Ardoy, A. Moretto, J.R. Granja

Unlocking the specificity of antimicrobial peptide interactions for membrane-targeted therapies
D. Conde-Torres, M. Calvelo, C. Rovira, Á. Piñeiro, R. Garcia-Fandino

Cyclodextrins: Establishing building blocks for AI-driven drug design by determining affinity constants in silico
A. Anderson*, Á. Piñeiro, R. García-Fandiño, M.S. O'Connor

Overlay databank unlocks data-driven analyses of biomolecules for all
A.M. Kiirikki, H.S. Antila, L.S. Bort, P. Buslaev, F. Favela-Rosales, T. Mendes Ferreira, P.F. J. Fuchs, R. Garcia-Fandino, I. Gushchin, B. Kav, N. Kučerka, P. Kula, M. Kurki, A. Kuzmin , A. Lalitha, F. Lolicato, J.J. Madsen, M.S. Miettinen, C. Mingham, L. Monticelli, R. Nencini, A.M. Nesterenko, T.J. Piggot, Á. Piñeiro, N. Reuter, S.Samantray, F. Suárez-Lestón, R. Talandashti, O. H. Samuli Ollila