activity
20242026
most citedMulti-objective generative AI for designing novel brain-targeting small molecules

3 citations · 3 across the 5 of their papers we have counts for

collaborators

5 papers

cs.AI2026

Unifying biomedical knowledge in a modern multimodal graph

Lucas Vittor, Ayush Noori, Iñaki Arango +5

Biomedical knowledge graphs (KGs) are widely used in the life sciences, yet many are derived from unstructured documents and therefore lack schema-level constraints, whereas graphs…

cs.AI2026

Autonomous Knowledge Graph Exploration with Adaptive Breadth-Depth Retrieval

Joaquín Polonuer, Lucas Vittor, Iñaki Arango +4

Retrieving evidence for language model queries from knowledge graphs requires balancing broad search across the graph with multi-hop traversal to follow relational links. Similarit…

q-bio.QM2025

Graph AI generates neurological hypotheses validated in molecular, organoid, and clinical systems

Ayush Noori, Joaquín Polonuer, Katharina Meyer +26

Neurological diseases are the leading global cause of disability, yet most lack disease-modifying treatments. We present PROTON, a heterogeneous graph transformer that generates te…

cs.CL2025

KnowGuard: Knowledge-Driven Abstention for Multi-Round Clinical Reasoning

Xilin Dang, Kexin Chen, Xiaorui Su +7

In clinical practice, physicians refrain from making decisions when patient information is insufficient. This behavior, known as abstention, is a critical safety mechanism preventi…

q-bio.BM2024★ 3 cited

Multi-objective generative AI for designing novel brain-targeting small molecules

Ayush Noori, Iñaki Arango, William E. Byrd +1

The strict selectivity of the blood-brain barrier (BBB) represents one of the most formidable challenges to successful central nervous system (CNS) drug delivery. Computational met…