| Generalized temporal acceleration scheme for kinetic monte carlo simulations of surface catalytic processes by scaling the rates of fast reactions EC Dybeck, CP Plaisance, M Neurock Journal of chemical theory and computation 13 (4), 1525-1538, 2017 | 76 | 2017 |
| Preferential activation of CO near hydrocarbon chains during Fischer–Tropsch synthesis on Ru D Hibbitts, E Dybeck, T Lawlor, M Neurock, E Iglesia Journal of catalysis 337, 91-101, 2016 | 63 | 2016 |
| Capturing entropic contributions to temperature-mediated polymorphic transformations through molecular modeling EC Dybeck, NS Abraham, NP Schieber, MR Shirts Crystal Growth & Design 17 (4), 1775-1787, 2017 | 53 | 2017 |
| Comparison of methods to reweight from classical molecular simulations to QM/MM potentials EC Dybeck, G Konig, BR Brooks, MR Shirts Journal of chemical theory and computation 12 (4), 1466-1480, 2016 | 52 | 2016 |
| Prediction of the relative free energies of drug polymorphs above zero kelvin M Yang, E Dybeck, G Sun, C Peng, B Samas, VM Burger, Q Zeng, Y Jin, ... Crystal Growth & Design 20 (8), 5211-5224, 2020 | 31 | 2020 |
| Exploring the multi-minima behavior of small molecule crystal polymorphs at finite temperature EC Dybeck, DP McMahon, GM Day, MR Shirts Crystal Growth & Design 19 (10), 5568-5580, 2019 | 29 | 2019 |
| Effects of a more accurate polarizable Hamiltonian on polymorph free energies computed efficiently by reweighting point-charge potentials EC Dybeck, NP Schieber, MR Shirts Journal of Chemical Theory and Computation 12 (8), 3491-3505, 2016 | 29 | 2016 |
| Using reweighting and free energy surface interpolation to predict solid-solid phase diagrams NP Schieber, EC Dybeck, MR Shirts The Journal of Chemical Physics 148 (14), 2018 | 24 | 2018 |
| Broadening the scope of binding free energy calculations using a Separated Topologies approach HM Baumann, E Dybeck, CL McClendon, FC Pickard IV, V Gapsys, ... Journal of Chemical Theory and Computation 19 (15), 5058-5076, 2023 | 7 | 2023 |
| A comparison of methods for computing relative anhydrous–hydrate stability with molecular simulation EC Dybeck, A Thiel, MJ Schnieders, FC Pickard IV, GPF Wood, ... Crystal growth & design 23 (1), 142-167, 2022 | 5 | 2022 |
| Noncovalent Host–Guest Complexes of Artemisinin with α-, β-, and γ-Cyclodextrin Examined by Structural Mass Spectrometry Strategies E Zlibut, JC May, Y Wei, D Gessmann, CS Wood, BA Bernat, TE Pugh, ... Analytical Chemistry 95 (21), 8180-8188, 2023 | 2 | 2023 |
| A Comparison of Methods for Computing Relative Hydrate-Anhydrous Stability with Molecular Simulation E Dybeck 2023 AIChE Annual Meeting, 2023 | | 2023 |
| Finite-Size Effects on the Chemical Potentials of Molecular Solids E Dybeck, G Wood 2020 Virtual AIChE Annual Meeting, 2020 | | 2020 |
| Transitioning from Graduate School to Your Future (Panel Discussion) E Dybeck 2020 Virtual AIChE Annual Meeting, 2020 | | 2020 |
| AIChE Young Professionals/Fellows Networking Session E Dybeck 2020 Virtual AIChE Annual Meeting, 2020 | | 2020 |
| Disorder and Entropy in Molecular Crystals M Shirts, N Abraham, E Dybeck, M Hock 2020 Virtual AIChE Annual Meeting, 2020 | | 2020 |
| Computational solid state pharmaceutics Y Abramov, E Dybeck 2020 Virtual AIChE Annual Meeting, 2020 | | 2020 |
| What to Expect Moving from Graduate School to Your Future A Bafana, C Thomas, LL Josephson, E Dybeck, K Henderson, A Khadilkar 2019 AIChE Annual Meeting, 2019 | | 2019 |
| Generalized Temporal Acceleration Scheme for Kinetic Monte Carlo Simulations of Surface Catalytic Processes C Plaisance, E Dybeck, M Andersen, M Neurock, K Reuter 2019 AIChE Annual Meeting, 2019 | | 2019 |
| A Comparison of Methods for Capturing Hydrate-Anhydrate Transition Thermodynamics E Dybeck, A Thiel, G Wood, F Pickard, M Schnieders 2019 AIChE Annual Meeting, 2019 | | 2019 |
