{"paper":{"title":"Graph-VQE: A CUDA-Q Multi-QPU Simulation Framework for Hamiltonian-Aware Protein-Folding VQE","license":"http://creativecommons.org/licenses/by/4.0/","headline":"","cross_cats":[],"primary_cat":"cs.ET","authors_text":"Bo Fang, Jingyi Huang, Qiang Guan, Shuai Xu, Yang Zhang, Yujun Feng, Yuqi Zhang","submitted_at":"2026-07-02T20:34:32Z","abstract_excerpt":"The Variational Quantum Eigensolver (VQE) is essential for molecular simulation in drug discovery, but hardware noise and algorithmic limits restrict its precision. While the NVIDIA CUDA-Q platform mitigates some hardware issues via exact simulation, it lacks Qiskit support and restricts parallelization. To solve this, we introduce Graph-VQE, a novel framework that extends CUDA-Q with optimization-level parallelism. Graph-VQE leverages amino acid sequence structures by partitioning Hamiltonian interaction graphs into weakly coupled clusters using Louvain community detection. These clusters und"},"claims":{"count":0,"items":[],"snapshot_sha256":"258153158e38e3291e3d48162225fcdb2d5a3ed65a07baac614ab91432fd4f57"},"source":{"id":"2607.02749","kind":"arxiv","version":1},"verdict":{"id":null,"model_set":{},"created_at":null,"strongest_claim":"","one_line_summary":"","pipeline_version":null,"weakest_assumption":"","pith_extraction_headline":""},"integrity":{"clean":true,"summary":{"advisory":0,"critical":0,"by_detector":{},"informational":0},"endpoint":"/pith/2607.02749/integrity.json","findings":[],"available":true,"detectors_run":[],"snapshot_sha256":"c28c3603d3b5d939e8dc4c7e95fa8dfce3d595e45f758748cecf8e644a296938"},"references":{"count":0,"sample":[],"resolved_work":0,"snapshot_sha256":"258153158e38e3291e3d48162225fcdb2d5a3ed65a07baac614ab91432fd4f57","internal_anchors":0},"formal_canon":{"evidence_count":0,"snapshot_sha256":"258153158e38e3291e3d48162225fcdb2d5a3ed65a07baac614ab91432fd4f57"},"author_claims":{"count":0,"strong_count":0,"snapshot_sha256":"258153158e38e3291e3d48162225fcdb2d5a3ed65a07baac614ab91432fd4f57"},"builder_version":"pith-number-builder-2026-05-17-v1"}