| Incorporating literature into an organic chemistry laboratory class: Translating lab activities online and encouraging the development of writing and presentation skills A Saar, M Mclaughlin, R Barlow, J Goetz, SA Adediran, A Gupta Journal of Chemical Education 97 (9), 3223-3229, 2020 | 27 | 2020 |
| OPLS/2020 Force Field for Unsaturated Hydrocarbons, Alcohols, and Ethers WL Jorgensen, MM Ghahremanpour, A Saar, J Tirado-Rives The Journal of Physical Chemistry B 128 (1), 250-262, 2023 | 12 | 2023 |
| Computation of absolute binding free energies for noncovalent inhibitors with SARS-CoV-2 main protease MM Ghahremanpour, A Saar, J Tirado-Rives, WL Jorgensen Journal of Chemical Information and Modeling 63 (16), 5309-5318, 2023 | 7 | 2023 |
| Assessing Metadynamics and Docking for Absolute Binding Free Energy Calculations Using Severe Acute Respiratory Syndrome Coronavirus 2 Main Protease Inhibitors A Saar, MM Ghahremanpour, J Tirado-Rives, WL Jorgensen Journal of Chemical Information and Modeling 63 (22), 7210-7218, 2023 | 6 | 2023 |
| Ensemble geometric deep learning of aqueous solubility MM Ghahremanpour, A Saar, J Tirado-Rives, WL Jorgensen Journal of Chemical Information and Modeling 63 (23), 7338-7349, 2023 | 2 | 2023 |
