Sort-based featurization plus autoencoders with an orthogonality loss yields permutation-symmetric collective variables whose reduced-model committor serves as a reaction coordinate for Lennard-Jones cluster transition rates.
Title resolution pending
1 Pith paper cite this work. Polarity classification is still indexing.
1
Pith paper citing it
fields
physics.chem-ph 1years
2025 1verdicts
CONDITIONAL 1representative citing papers
citing papers explorer
-
Learning collective variables that respect permutational symmetry
Sort-based featurization plus autoencoders with an orthogonality loss yields permutation-symmetric collective variables whose reduced-model committor serves as a reaction coordinate for Lennard-Jones cluster transition rates.