Rapid planning and analysis of high-throughput experiment arrays for reaction discovery B Mahjour, R Zhang, Y Shen, A McGrath, R Zhao, OG Mohamed, Y Lin, ... Nature Communications 14 (1), 3924, 2023 | 26 | 2023 |
Reinforcing the supply chain of umifenovir and other antiviral drugs with retrosynthetic software Y Lin, Z Zhang, B Mahjour, D Wang, R Zhang, E Shim, A McGrath, Y Shen, ... Nature Communications 12 (1), 7327, 2021 | 16 | 2021 |
Reinforcing the supply chain of COVID-19 therapeutics with expert-coded retrosynthetic software Y Lin, Z Zhang, B Mahjour, D Wang, R Zhang, E Shim, A McGrath, Y Shen, ... | 9 | 2020 |
Repurposing amine and carboxylic acid building blocks with an automatable esterification reaction A McGrath, R Zhang, K Shafiq, T Cernak Chemical Communications 59 (8), 1026-1029, 2023 | 6 | 2023 |
Author Correction: Reinforcing the supply chain of umifenovir and other antiviral drugs with retrosynthetic software Y Lin, Z Zhang, B Mahjour, D Wang, R Zhang, E Shim, A McGrath, Y Shen, ... Nature Communications 13, 2022 | 4 | 2022 |
Exploring the combinatorial explosion of amine–acid reaction space via graph editing R Zhang, B Mahjour, A Outlaw, A McGrath, T Hopper, B Kelley, ... Communications Chemistry 7 (1), 22, 2024 | 3 | 2024 |
Catalyst: Systems chemistry links reactions to molecular function H Huang, A McGrath, CO Audu, T Cernak Chem, 2024 | 1 | 2024 |
Interactive Python Notebook Modules for Chemoinformatics in Medicinal Chemistry B Mahjour, A McGrath, A Outlaw, R Zhao, C Zhang, T Cernak Journal of Chemical Education 100 (12), 4895-4902, 2023 | 1 | 2023 |
Synthesis and NMR Characterization of a Dihydropyrazine, a Tetrahydroquinoxaline and a Tetrahydrooxadiazolopyrazine MK Knoerzer, GR Hoffman, HK Maben, AT McGrath, AD Outlaw, B Mayer, ... NMR Spectroscopy in the Undergraduate Curriculum, Volume 4: In-Person and …, 2021 | 1 | 2021 |
The Development of Unorthodox Amine-Acid Coupling Reactions and Their Applications Towards Complex Molecules for a Systems Approach to Chemistry A McGrath | | 2024 |
Diverse Amine-Acid Coupling Reactions Modulate the Potency of BRD4 PROTACs A McGrath, H Huang, JF Brazeau, Z Zhang, NA Vellore, L Zhu, Z Shi, ... | | 2023 |
Reinforcing the supply chain of umifenovir and other antiviral drugs with retrosynthetic software (vol 12, 7327, 2021) Y Lin, Z Zhang, B Mahjour, D Wang, R Zhang, E Shim, A McGrath, Y Shen, ... NATURE COMMUNICATIONS 13 (1), 2022 | | 2022 |
Property modulation with chemical transformations T Cernak, B Mahjour, Y Shen, A McGrath, R Zhang US Patent App. 16/836,481, 2020 | | 2020 |
Bromomalonate-Catalyzed Esterification of Alkyl Pyridinium Salts with Carboxylic Acids A McGrath, K Shafiq | | 2020 |
Sonogashira coupling reactions with bromomethyl quinoxaline derivatives A McGrath, K Stewart, A Schoffstall ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY 255, 2018 | | 2018 |
Synthesis and reactions of dicyanopyrazines A McGrath, A Schoffstall ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY 253, 2017 | | 2017 |
Bromomalonate-Catalyzed Esterification of Alkyl Pyridinium Salts with Carboxylic Acids K Shafiq, A McGrath | | |