| OPLS3e: Extending force field coverage for drug-like small molecules K Roos, C Wu, W Damm, M Reboul, JM Stevenson, C Lu, MK Dahlgren, ... Journal of chemical theory and computation 15 (3), 1863-1874, 2019 | 827 | 2019 |
| Mayer bond order as a metric of complexation effectiveness in lead halide perovskite solutions J Stevenson, B Sorenson, VH Subramaniam, J Raiford, PP Khlyabich, ... Chemistry of Materials 29 (6), 2435-2444, 2017 | 100 | 2017 |
| Membrane alternatives in worlds without oxygen: Creation of an azotosome J Stevenson, J Lunine, P Clancy Science advances 1 (1), e1400067, 2015 | 87 | 2015 |
| Computational implementation of nudged elastic band, rigid rotation, and corresponding force optimization HC Herbol, J Stevenson, P Clancy Journal of Chemical Theory and Computation 13 (7), 3250-3259, 2017 | 39 | 2017 |
| Transferable neural network potential energy surfaces for closed-shell organic molecules: Extension to ions LD Jacobson, JM Stevenson, F Ramezanghorbani, D Ghoreishi, ... Journal of Chemical Theory and Computation 18 (4), 2354-2366, 2022 | 34 | 2022 |
| High-dimensional neural network potential for liquid electrolyte simulations S Dajnowicz, G Agarwal, JM Stevenson, LD Jacobson, ... The Journal of Physical Chemistry B 126 (33), 6271-6280, 2022 | 28 | 2022 |
| Solvation of nitrogen compounds in Titan’s seas, precipitates, and atmosphere JM Stevenson, WA Fouad, D Shalloway, D Usher, J Lunine, ... Icarus 256, 1-12, 2015 | 20 | 2015 |
| Pentacene-based nanorods on Au (111) single crystals: Charge transfer, diffusion, and step-edge barriers SA Savu, S Abb, S Schundelmeier, JD Saathoff, JM Stevenson, ... Nano Research 6, 449-459, 2013 | 17 | 2013 |
| Schr\" odinger-ANI: An Eight-Element Neural Network Interaction Potential with Greatly Expanded Coverage of Druglike Chemical Space JM Stevenson, LD Jacobson, Y Zhao, C Wu, J Maple, K Leswing, ... arXiv preprint arXiv:1912.05079, 2019 | 13 | 2019 |
| Uncovering the reaction mechanism initiating the nucleation of lead sulfide quantum dots in a hines synthesis JM Stevenson, AW Ruttinger, P Clancy Journal of Materials Chemistry A 6 (20), 9402-9410, 2018 | 13 | 2018 |
| Simple molecular reactive force field for metal–organic synthesis J Andrejevic, J Stevenson, P Clancy Journal of Chemical Theory and Computation 12 (2), 825-838, 2016 | 5 | 2016 |
| Leveraging multitask learning to improve the transferability of machine learned force fields L Jacobson, J Stevenson, F Ramezanghorbani, S Dajnowicz, K Leswing | 4 | 2023 |
| Development of scalable and generalizable machine learned force field for polymers S Mohanty, J Stevenson, AR Browning, L Jacobson, K Leswing, MD Halls, ... Scientific Reports 13 (1), 17251, 2023 | 2 | 2023 |
| Transfer learning lithium and electrolyte potential energy surfaces from pure and hybrid DFT JM Stevenson, LD Jacobson, G Agarwal, S Dajnowicz AI for Accelerated Materials Design NeurIPS 2022 Workshop, 2022 | 1 | 2022 |
| Machine learning force field ranking of candidate solid electrolyte interphase structures in Li-ion batteries J Stevenson, G Agarwal, L Jacobson | | 2023 |
| Lancelot-an Open-Source Codebase for Simplified Computational Chemistry HC Herbol, J Stevenson, Y Acevedo, A Ruttinger, P Clancy 2018 AIChE Annual Meeting, 2018 | | 2018 |
| Achieving a high level of accuracy in modeling protein-ligand binding E Harder, C Wu, W Damm, A Roos, M Reboul, J Stevenson, R Abel ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY 256, 2018 | | 2018 |
| Towards the rational design of solvents that give rise to highly efficient solution-processed perovskite solar cells P Clancy, B Sorenson, A Harper, JM Stevenson Proceedings of the 2016 Winter Simulation Conference, 14-22, 2016 | | 2016 |
| All-atom modeling for solution-processed solar cell JM Stevenson Cornell University, 2016 | | 2016 |
| Thin film deposition processes in" small molecule" organic semiconductor systems P Clancy, JD Saathoff, JM Stevenson ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY 246, 2013 | | 2013 |
