most citedScalable Bayesian Optimization for High-Dimensional Coarse-Grained Model Parameterization

1 citations · 1 across the 7 of their papers we have counts for

collaborators

8 papers

quant-ph2026

Binary Optimization of Measurement Groupings for Quantum Energy Estimation

Isaac L. Huidobro-Meezs, Rodrigo A. Vargas-Hernández

Repeated measurements can dominate the resources required for quantum energy estimation, making the choice of which Pauli observables to measure together a central optimization pro…

quant-ph2026

Bottom-Up Design of Quantum Optical Experiments Using Discrete Generative Models

Isaac L. Huidobro-Meezs, Simón Paiva-Ortega, Rodrigo A. Vargas-Hernández

Designing quantum optical experiments requires searching over discrete circuit topologies and continuous parameters, often with multiple realizations of the same target state. Grap…

quant-ph2026

Reducing quantum measurements in qubit-based overlapping grouping methods for quantum energy estimation through better initializations

Isaac L. Huidobro-Meezs, Rodrigo A. Vargas-Hernández

The measurement cost for estimating expectation values of Hamiltonians is a central bottleneck in variational quantum algorithms. Grouping strategies significantly reduce this cost…

cs.LG2025

Spectral Analysis of Molecular Features: When Richer Features Do Not Guarantee Better Generalization

Asma Jamali, Tin Sum Cheng, Rodrigo A. Vargas-Hernández

The spectral properties of feature embeddings offer critical insights into model generalization and representation quality. While deep learning models are widely used for molecular…

cs.LG2025

Meta-Learning Fourier Neural Operators for Hessian Inversion and Enhanced Variational Data Assimilation

Hamidreza Moazzami, Asma Jamali, Nicholas Kevlahan +1

Data assimilation (DA) is crucial for enhancing solutions to partial differential equations (PDEs), such as those in numerical weather prediction, by optimizing initial conditions…

quant-ph2025

Discrete Flow-Based Generative Models for Measurement Optimization in Quantum Computing

Isaac L. Huidobro-Meezs, Jun Dai, Rodrigo A. Vargas-Hernández

Estimating molecular Hamiltonians to chemical accuracy requires a large number of measurements. Hamiltonian overlapping grouping methods focus on reducing measurement counts, emplo…

cs.CV2025

LivePyxel: Accelerating image annotations with a Python-integrated webcam live streaming

Uriel Garcilazo-Cruz, Joseph O. Okeme, Rodrigo A. Vargas-Hernández

The lack of flexible annotation tools has hindered the deployment of AI models in some scientific areas. Most existing image annotation software requires users to upload a precolle…

cond-mat.mtrl-sci2025★ 1 cited

Scalable Bayesian Optimization for High-Dimensional Coarse-Grained Model Parameterization

Carlos A. Martins Junior, Daniela A. Damasceno, Keat Yung Hue +3

Coarse-grained (CG) force field models are extensively utilised in material simulations due to their scalability. Traditionally, these models are parameterized using hybrid strateg…