Andrea Levy

Andrea Levy

École Polytechnique Fédérale de Lausanne - Lausanne / Switzerland
Natural Sciences / Chemical Sciences
AD Scientific Index ID: 5375332
Eidgenössische Technische Hochschule Lausanne
person_outline Andrea Levy's MOST POPULAR ARTICLES
1-) Metal3D: a general deep learning framework for accurate metal ion location prediction in proteinsSL Dürr, A Levy, U RothlisbergerNature Communications 14 (1), 2713, 202316*2023
2-) Exploring the drug loading mechanism of photoactive inorganic nanocarriers through molecular dynamics simulationsS Motta, P Siani, A Levy, C Di ValentinNanoscale 13 (30), 13000-13013, 2021
3-) MiMiCPy: An Efficient Toolkit for MiMiC-Based QM/MM SimulationsB Raghavan, FK Schackert, A Levy, SK Johnson, E Ippoliti, D Mandelli, ...Journal of Chemical Information and Modeling 63 (5), 1406-1412, 2023
4-) MiMiC: A high-performance framework for multiscale molecular dynamics simulationsA Antalík, A Levy, S Kvedaravičiūtė, SK Johnson, D Carrasco-Busturia, ...The Journal of Chemical Physics 161 (2), 2024
5-) OpenMM-MiMiC Interface for Efficient and Flexible Multiscale SimulationsA Levy, A Antalík, JMH Olsen, U RothlisbergerarXiv preprint arXiv:2502.06539, 2025