Miguel Angel Soler Bastida
AuthID: R-001-07H
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TITLE: Bluues_cplx: Electrostatics at Protein–Protein and Protein–Ligand Interfaces Full Text
AUTHORS: Miguel Angel Soler; Rayyan Bassem Adel Yakout; Ozge Ozkilinc; Gennaro Esposito; Walter Rocchia; Christian Klein; Federico Fogolari;
PUBLISHED: 2025, SOURCE: Molecules, VOLUME: 30, ISSUE: 1
AUTHORS: Miguel Angel Soler; Rayyan Bassem Adel Yakout; Ozge Ozkilinc; Gennaro Esposito; Walter Rocchia; Christian Klein; Federico Fogolari;
PUBLISHED: 2025, SOURCE: Molecules, VOLUME: 30, ISSUE: 1
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TITLE: Computational Mutagenesis of Antibody Fragments: Disentangling Side Chains from ΔΔ<i>G</i> Predictions
AUTHORS: Tandiana, R; Barletta, GP; Soler, MA; Fortuna, S; Rocchia, W;
PUBLISHED: 2024, SOURCE: JOURNAL OF CHEMICAL THEORY AND COMPUTATION, VOLUME: 20, ISSUE: 6
AUTHORS: Tandiana, R; Barletta, GP; Soler, MA; Fortuna, S; Rocchia, W;
PUBLISHED: 2024, SOURCE: JOURNAL OF CHEMICAL THEORY AND COMPUTATION, VOLUME: 20, ISSUE: 6
3
TITLE: Reactive natural deep eutectic solvents increase selectivity and efficiency of lipase catalyzed esterification of carbohydrate polyols Full Text
AUTHORS: Buzatu, AR; Soler, MA; Fortuna, S; Ozkilinc, O; Dreava, DM; Bîtcan, I; Badea, V; Giannozzi, P; Fogolari, F; Gardossi, L; Peter, F; Todea, A; Boeriu, CG;
PUBLISHED: 2024, SOURCE: CATALYSIS TODAY, VOLUME: 426
AUTHORS: Buzatu, AR; Soler, MA; Fortuna, S; Ozkilinc, O; Dreava, DM; Bîtcan, I; Badea, V; Giannozzi, P; Fogolari, F; Gardossi, L; Peter, F; Todea, A; Boeriu, CG;
PUBLISHED: 2024, SOURCE: CATALYSIS TODAY, VOLUME: 426
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TITLE: Lipase-catalysed esterification in a reactive natural deep eutectic solvent leads to lauroylcholine chloride rather than glucose ester
AUTHORS: Buzatu, AR; Soler, MA; Ozkilinc, O; Fortuna, S; Dreava, DM; Bîtcan, I; Giannozzi, P; Fogolari, F; Gardossi, L; Peter, F; Todea, A; Boeriu, CG;
PUBLISHED: 2024, SOURCE: REACTION CHEMISTRY & ENGINEERING
AUTHORS: Buzatu, AR; Soler, MA; Ozkilinc, O; Fortuna, S; Dreava, DM; Bîtcan, I; Giannozzi, P; Fogolari, F; Gardossi, L; Peter, F; Todea, A; Boeriu, CG;
PUBLISHED: 2024, SOURCE: REACTION CHEMISTRY & ENGINEERING
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TITLE: Statistical accuracy of molecular dynamics-based methods for sampling conformational ensembles of disordered proteins Full Text
AUTHORS: Bastida, A; Zúñiga, J; Fogolari, F; Soler, MA;
PUBLISHED: 2024, SOURCE: PHYSICAL CHEMISTRY CHEMICAL PHYSICS, VOLUME: 26, ISSUE: 35
AUTHORS: Bastida, A; Zúñiga, J; Fogolari, F; Soler, MA;
PUBLISHED: 2024, SOURCE: PHYSICAL CHEMISTRY CHEMICAL PHYSICS, VOLUME: 26, ISSUE: 35
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TITLE: Locuaz: an in silico platform for protein binders optimization Full Text
AUTHORS: Barletta, GP; Tandiana, R; Soler, M; Fortuna, S; Rocchia, W;
PUBLISHED: 2024, SOURCE: BIOINFORMATICS, VOLUME: 40, ISSUE: 8
AUTHORS: Barletta, GP; Tandiana, R; Soler, M; Fortuna, S; Rocchia, W;
PUBLISHED: 2024, SOURCE: BIOINFORMATICS, VOLUME: 40, ISSUE: 8
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TITLE: Replica-exchange optimization of antibody fragments
AUTHORS: Soler, MA; Minovski, N; Rocchia, W; Fortuna, S;
PUBLISHED: 2023, SOURCE: COMPUTATIONAL BIOLOGY AND CHEMISTRY, VOLUME: 103
AUTHORS: Soler, MA; Minovski, N; Rocchia, W; Fortuna, S;
PUBLISHED: 2023, SOURCE: COMPUTATIONAL BIOLOGY AND CHEMISTRY, VOLUME: 103
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TITLE: A PAK1 Mutational Hotspot Within the Regulatory CRIPaK Domain is Associated With Severe Neurodevelopmental Disorders in Children
AUTHORS: Giovanna Scorrano; Gianluca D'Onofrio; Andrea Accogli; Mariasavina Severino; Rebecca Buchert; Urania Kotzaeridou; Giulia Iapadre; Giovanni Farello; Michele Iacomino; Fedele Dono; Ludovica Di Francesco; Maria Francesca Fiorile; Saverio La Bella; Antonio Corsello; Elisa Calì; Gabriella Di Rosa; Eloisa Gitto; Alberto Verrotti; Sara Fortuna; Miguel A Soler; ...More
PUBLISHED: 2023, SOURCE: Pediatric Neurology, VOLUME: 149
AUTHORS: Giovanna Scorrano; Gianluca D'Onofrio; Andrea Accogli; Mariasavina Severino; Rebecca Buchert; Urania Kotzaeridou; Giulia Iapadre; Giovanni Farello; Michele Iacomino; Fedele Dono; Ludovica Di Francesco; Maria Francesca Fiorile; Saverio La Bella; Antonio Corsello; Elisa Calì; Gabriella Di Rosa; Eloisa Gitto; Alberto Verrotti; Sara Fortuna; Miguel A Soler; ...More
PUBLISHED: 2023, SOURCE: Pediatric Neurology, VOLUME: 149
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TITLE: Molecular electrostatics and pKa shifts calculations with the Generalized Born model. A tutorial through examples with Bluues2
AUTHORS: Soler, MA; Ozkilinc, O; Hunashal, Y; Giannozzi, P; Esposito, G; Fogolari, F;
PUBLISHED: 2023, SOURCE: COMPUTER PHYSICS COMMUNICATIONS, VOLUME: 287
AUTHORS: Soler, MA; Ozkilinc, O; Hunashal, Y; Giannozzi, P; Esposito, G; Fogolari, F;
PUBLISHED: 2023, SOURCE: COMPUTER PHYSICS COMMUNICATIONS, VOLUME: 287
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TITLE: Description of conformational ensembles of disordered proteins by residue-local probabilities
AUTHORS: Bastida, A; Zúñiga, J; Miguel, B; Soler, MA;
PUBLISHED: 2023, SOURCE: PHYSICAL CHEMISTRY CHEMICAL PHYSICS, VOLUME: 25, ISSUE: 15
AUTHORS: Bastida, A; Zúñiga, J; Miguel, B; Soler, MA;
PUBLISHED: 2023, SOURCE: PHYSICAL CHEMISTRY CHEMICAL PHYSICS, VOLUME: 25, ISSUE: 15
