Philippe Schwaller
Philippe Schwaller has 2 papers in our library, in 2023–2024, most of them on Language models & pretraining; often with Andrew D White, Sam Cox.
OpenAlex · ORCID · Wikidata · h-index 32 · 201 works · 8,590 citations OpenAlex, 2026-10-14
📄 2 works in our library · 🔗 Cited 326 times in our library · 1 more in our library without a page yet · ⭐ Paper Stars ranking: #3909
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Fields, topics and concepts
📚 Shelves 7The field of science this work belongs to (OpenAlex fields).Computer Science · 2 worksMaterials Science · 2 worksComputational Theory and Mathematics · 2 worksMaterials Chemistry · 2 worksChemistry · 1 workPhysical and Theoretical Chemistry · 1 workArtificial Intelligence · 1 work
🧭 Topics 1Research subjects and languages the work is about.Language models & pretraining · 2 works
Works by year
2020s
Papers
- Leveraging large language models for predictive chemistry (2024 · 392 citations)
Chemistry datasets are usually small, so researchers tend to build bespoke machine learning models with hand-crafted chemical descriptors. - ChemCrow: Augmenting large-language models with chemistry tools (2023 · 211 citations)
General-purpose LLMs such as GPT-4 often fail at chemistry. They cannot reliably convert IUPAC names into structures, and they have no access to specialised software or databases. Meanwhile, many strong computational chemistry tools exist, but non-programmers find them hard to combine. ChemCrow addresses both…
All works
- Leveraging large language models for predictive chemistryNature Machine IntelligenceKevin Maik Jablonka, Philippe Schwaller, Andres Ortega‐Guerrero, et al.2024 · 392 citations
- ChemCrow: Augmenting large-language models with chemistry toolsarXiv:2304.05376Andres M Bran, Sam Cox, Oliver Schilter, et al.2023 · 211 citations
- Targeting protein–ligand neosurfaces with a generalizable deep learning tool ↗Nature · no summary yetAnthony Marchand et al.2025 · 81 citations
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