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Maximum Likelihood Estimators (MLE) has many good properties. For example, the asymptotic variance of MLE solution attains equality of the asymptotic Cram{\'e}r-Rao lower bound (efficiency bound), which is the minimum possible variance for…
Deploying vision foundation models typically relies on efficient adaptation strategies, whereas conventional full fine-tuning suffers from prohibitive costs and low efficiency. While delta-tuning has proven effective in boosting the…
Quantifying image distortions caused by strong gravitational lensing and estimating the corresponding matter distribution in lensing galaxies has been primarily performed by maximum likelihood modeling of observations. This is typically a…
Deep Learning (DL) , a variant of the neural network algorithms originally proposed in the 1980s, has made surprising progress in Artificial Intelligence (AI), ranging from language translation, protein folding, autonomous cars, and more…
Calculating or accurately estimating log-determinants of large positive definite matrices is of fundamental importance in many machine learning tasks. While its cubic computational complexity can already be prohibitive, in modern…
Direct numerical simulations (DNS) are an indispensable tool for understanding the fundamental physics of turbulent flows. Because of their steep increase in computational cost with Reynolds number ($R_{\lambda}$), well-resolved DNS are…
Due to efficient scaling with electron number N, density functional theory (DFT) is widely used for studies of large molecules and solids. Restriction of an exact mean-field theory to local potential functions has recently been questioned.…
Diffusion Large Language Models (dLLMs) have emerged as a promising paradigm for parallel token generation, with block-wise variants garnering significant research interest. Despite their potential, existing dLLMs typically suffer from a…
Large language models (LLMs) have achieved remarkable success in many natural language processing (NLP) tasks. To achieve more accurate output, the prompts used to drive LLMs have become increasingly longer, which incurs higher…
We investigate the impact of choosing regressors and molecular representations for the construction of fast machine learning (ML) models of thirteen electronic ground-state properties of organic molecules. The performance of each…
Density Functional Theory (DFT) is a pivotal method within quantum chemistry and materials science, with its core involving the construction and solution of the Kohn-Sham Hamiltonian. Despite its importance, the application of DFT is…
Density functional theory (DFT) is one of the main methods in Quantum Chemistry that offers an attractive trade off between the cost and accuracy of quantum chemical computations. The electron density plays a key role in DFT. In this work,…
We propose a natural application of Quantum Linear Systems Problem (QLSP) solvers such as the HHL algorithm to efficiently prepare highly excited interior eigenstates of physical Hamiltonians in a variational and targeted manner. This is…
Clinical diagnostic guidelines outline the key questions to answer to reach a diagnosis. Inspired by guidelines, we aim to develop a model that learns from electronic health records to determine the optimal sequence of actions for accurate…
The mildly non-linear regime of cosmic structure formation holds much of the information that upcoming large-scale structure surveys aim to exploit, making fast and accurate predictions on these scales essential. We present the $N$-body…
The 3D matter power spectrum, $P_{\delta}(k,z)$ is a fundamental quantity in the analysis of cosmological data such as large-scale structure, 21cm observations, and weak lensing. Existing computer models (Boltzmann codes) such as CLASS can…
DBSCAN is widely used in many scientific and engineering fields because of its simplicity and practicality. However, due to its high sensitivity parameters, the accuracy of the clustering result depends heavily on practical experience. In…
In this work, we develop a simulation-based model to predict the density split (DSS) and second-order shear and clustering statistics. A simulation-based model has the potential to model highly non-linear scales where current DSS models…
Tensor-based multi-view clustering has recently received significant attention due to its exceptional ability to explore cross-view high-order correlations. However, most existing methods still encounter some limitations. (1) Most of them…
The differential p_T spectrum for vector boson production is computed at next-to-leading fixed order and including the resummation of threshold logarithms at next-to-next-to-leading logarithmic accuracy. A comparison is made to ATLAS data…