Orientation-independent room temperature optical 13C hyperpolarization in powdered diamond A Ajoy, K Liu, R Nazaryan, X Lv, PR Zangara, B Safvati, G Wang, D Arnold, ... Science advances 4 (5), eaar5492, 2018 | 130 | 2018 |
Hyperpolarized relaxometry based nuclear T1 noise spectroscopy in diamond A Ajoy, B Safvati, R Nazaryan, JT Oon, B Han, P Raghavan, R Nirodi, ... Nature communications 10 (1), 5160, 2019 | 45 | 2019 |
Autonomous platforms for data-driven organic synthesis W Gao, P Raghavan, CW Coley Nature Communications 13 (1), 1075, 2022 | 39 | 2022 |
Dataset design for building models of chemical reactivity P Raghavan, BC Haas, ME Ruos, J Schleinitz, AG Doyle, SE Reisman, ... ACS Central Science 9 (12), 2196-2204, 2023 | 16 | 2023 |
Enhanced Optical 13C Hyperpolarization in Diamond Treated by High‐Temperature Rapid Thermal Annealing M Gierth, V Krespach, AI Shames, P Raghavan, E Druga, N Nunn, ... Advanced Quantum Technologies 3 (10), 2000050, 2020 | 15 | 2020 |
High temperature annealing enhanced diamond 13C hyperpolarization at room temperature M Gierth, V Krespach, AI Shames, P Raghavan, E Druga, N Nunn, ... arXiv preprint arXiv:1911.03322, 2019 | 2 | 2019 |
Incorporating Synthetic Accessibility in Drug Design: Predicting Reaction Yields of Suzuki Cross-Couplings by Leveraging AbbVie’s 15-Year Parallel Library Data Set P Raghavan, AJ Rago, P Verma, MM Hassan, GM Goshu, ... Journal of the American Chemical Society, 2024 | | 2024 |
Substrate Scope Contrastive Learning: Repurposing Human Bias to Learn Atomic Representations W Gao, P Raghavan, R Shprints, CW Coley arXiv preprint arXiv:2402.16882, 2024 | | 2024 |
Hyperpolarized Relaxometry for Nuclear T1 Noise Spectroscopy in Hybrid Diamond Quantum Registers A Ajoy, B Safvati, R Nazaryan, JT Oon, B Han, P Raghavan, R Nirodi, ... Phys. Rev. Lett 107 (230501), 2, 2011 | | 2011 |
Predicting Small-Molecule Substrate Reactivity via Data Mining and Machine Learning J Burns, P Raghavan, C Coley | | |