86 citations · 426 across the 11 of their papers we have counts for
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Structure and polymerization of liquid sulfur across the -transition
Manyi Yang, Enrico Trizio, Michele Parrinello
The anomalous -transition of liquid sulfur, which is supposed to be related to the transformation of eight-membered sulfur rings into long polymeric chains, has attracted consid…
A unified framework for machine learning collective variables for enhanced sampling simulations:
Luigi Bonati, Enrico Trizio, Andrea Rizzi +1
Identifying a reduced set of collective variables is critical for understanding atomistic simulations and accelerating them through enhanced sampling techniques. Recently, several…
Deep Learning Collective Variables from Transition Path Ensemble
Dhiman Ray, Enrico Trizio, Michele Parrinello
The study of the rare transitions that take place between long lived metastable states is a major challenge in molecular dynamics simulations. Many of the methods suggested to addr…