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2020 – today
- 2023
[j4]Silvia Gervasoni
, Isilay Öztürk, Camilla Guccione, Andrea Bosin, Paolo Ruggerone, Giuliano Malloci:
Interaction of Radiopharmaceuticals with Somatostatin Receptor 2 Revealed by Molecular Dynamics Simulations. J. Chem. Inf. Model. 63(15): 4924-4933 (2023)
2010 – 2019
- 2011
- [j3]Xevi Biarnés, Salvatore Bongarzone, Attilio Vittorio Vargiu, Paolo Carloni, Paolo Ruggerone:
Molecular motions in drug design: the coming age of the metadynamics method. J. Comput. Aided Mol. Des. 25(5): 395-402 (2011) - 2010
- [j2]Robert Schulz, Attilio Vittorio Vargiu, Francesca Collu, Ulrich Kleinekathöfer, Paolo Ruggerone:
Functional Rotation of the Transporter AcrB: Insights into Drug Extrusion from Simulations. PLoS Comput. Biol. 6(6) (2010)
2000 – 2009
- 2008
- [j1]Katrin Spiegel, Alessandra Magistrato, Patrick Maurer, Paolo Ruggerone, Ursula Rothlisberger, Paolo Carloni, Jan Reedijk, Michael L. Klein:
Parameterization of azole-bridged dinuclear platinum anticancer drugs via a QM/MM force matching procedure. J. Comput. Chem. 29(1): 38-49 (2008)
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