GRAZZI, ANDREA
GRAZZI, ANDREA
Dipartimento di Chimica
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Risultati 1 - 6 di 6 (tempo di esecuzione: 0.001 secondi).
Efficient Protein–Ligand Binding Free Energy Estimation with Coarse-Grained Funnel Metadynamics
2026 A. Grazzi, C.M. Brown, M. Sironi, S.J. Marrink, S. Pieraccini
Ligand Binding Free Energy Landscapes at the Tubulin Colchicine Site from Coarse-Grained Metadynamics
2026 A. Grazzi, C.M. Brown, M. Sironi, S.J. Marrink, S. Pieraccini
Development of a Coarse-grained Simulation Approach to Elucidate Multisite Tubulin-ligand Binding
2025 A. Grazzi, C.M. Brown, S.J. Marrink, M. Sironi, S. Pieraccini
Efficient Binding Free Energy Estimation with Coarse-Grained Funnel Metadynamics
2025 A. Grazzi, C.M. Brown, M. Sironi, S.J. Marrink, S. Pieraccini
Development of a Coarse-Grained Molecular Dynamics (CG-MD) approach to explore tubulin-ligand binding
2024 A. Grazzi, M. Sironi, S. Pieraccini
A millisecond coarse-grained simulation approach to decipher allosteric cannabinoid binding at the glycine receptor α1
2024 A. Bartocci, A. Grazzi, N. Awad, P. Corringer, P.C.T. Souza, M. Cecchini