High-Dimensional Enhanced Sampling via Regularized Path-Dependent McKean--Vlasov Dynamics using Tensor Density Approximation
This paper proposes a scalable, regularized path-dependent McKean-Vlasov framework for high-dimensional enhanced sampling that improves statistical stability through path-history measures and achieves efficient numerical realization via optimization-free tensor density approximation, enabling effective exploration of complex energy landscapes with collective variable dimensions up to 64.