@article{foundationmodelsfordiscoveryandexplorati, title = {Foundation Models for Discovery and Exploration in Chemical Space}, author = {Alexius Wadell and Anoushka Bhutani and Victor Azumah and Austin R. Ellis-Mohr and Andrew J. Stier and Kareem Hegazy and Alexander Brace and Hancheng Zhao and Celia Kelly and Anuj K. Nayak and Yuhan Chen and Dimitrios Simatos and Hongyi Lin and Murali Emani and Venkatram Vishwanath and Kevin Gering and Melisa Alkan and Tom Gibbs and Jack Wells and Wesley W. Qian and Richard C. Gerkin and Benjamin Amorelli and Alexander B. Wiltschko and Lav R. Varshney and Bharath Ramsundar and Karthik Duraisamy and Michael W. Mahoney and Arvind Ramanathan and Venkatasubramanian Viswanathan}, year = {2025}, eprint = {2510.18900}, archivePrefix = {arXiv}, url = {https://arxiv.org/abs/2510.18900}, }