Understanding and improving zeroth-order optimization methods on AI-driven molecule optimization
- Elvin Lo
- Pin-Yu Chen
- 2023
- Digital Discovery
Paper
Publications
26914 results for Science
Fueling the Digital Chemistry Revolution with Language Models
- Antonio Cardinale
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- et al.
- 2023
- Chimia
PaperHow to Bind Anonymous Credentials to Humans
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- Nitin Singh
- et al.
- 2023
- USENIX Security 2023
Conference paperStandardizing chemical compounds with language models
- Miruna T Cretu
- Alessandra Toniato
- et al.
- 2023
- Machine Learning: Science and Tech.
PaperDemonstration of the Nonlocal Josephson Effect in Andreev Molecules
- Daniel Z. Haxell
- Marco Coraiola
- et al.
- 2023
- Nano Letters
PaperHarnessing Quantum Computing for Direct Air Capture Materials Discovery
- Marco Antonio Guimaraes Auad Barroca
- Rodrigo Neumann Barros Ferreira
- et al.
- 2023
- Paraty Quantum Information School and Workshop 2023
PosterGenerative Perturbation Analysis for Probabilistic Black-Box Anomaly Attribution
- Tsuyoshi Idé
- Naoki Abe
- 2023
- KDD 2023
Conference paperScope 3 emission estimation using large language models
- 2023
- KDD 2023
Workshop paperIntegrating Chemical Language and Physicochemical Features for Enhanced Molecular Property Prediction with Multimodal Language Models
- Eduardo Almeida Soares
- Emilio Ashton Vital Brazil
- et al.
- 2023
- KDD 2023
Workshop paperFragile Earth: AI for Climate Sustainability - From Wildfire Disaster Management to Public Health and Beyond
- Naoki Abe
- Kathleen Buckingham
- et al.
- 2023
- KDD 2023
Workshop