Article

Phenotype-Guided In Silico Molecular Generation Using Large Language Models

2026-01-03

Abstract excerpt

Complex diseases often emerge from coordinated, system-level cellular state changes that are difficult to address with target centric drug discovery. Phenotypic drug discovery offers a principled alternative but remains constrained by the cost and scalability of pathologically relevant assays. Here we present GEMGen, a large language model–based framework that performs in silico phenotypic drug discovery by genera...

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Literature Corpus work: eab76290-e85a-5a74-8948-1c7823f8d2c8
DOI: 10.64898/2026.01.03.697483

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