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20232026
most citedSHAPNN: Shapley Value Regularized Tabular Neural Network

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cond-mat.mtrl-sci2024

Efficient Generation of Molecular Clusters with Dual-Scale Equivariant Flow Matching

Akshay Subramanian, Shuhui Qu, Cheol Woo Park +3

Amorphous molecular solids offer a promising alternative to inorganic semiconductors, owing to their mechanical flexibility and solution processability. The packing structure of th…