BiophysicsbioRxivPreprint
Characterization of PROTACs by Ternary Complex Landscape Exploration using Monte Carlo simulations
Anna M. Díaz-Rovira, Carles Perez‐Lopez, Jordi Martín-Pérez…·Vı́ctor Guallar
The paper uses Monte Carlo simulations to analyze the dynamic energy landscapes of PROTAC ternary complexes, identifying stable conformations and supporting PROTAC optimization.
DOI 10.1101/2025.04.11.648328