| Free energy calculations of membrane permeation: Challenges due to strong headgroup–solute interactions N Pokhrel, L Maibaum Journal of chemical theory and computation 14 (3), 1762-1771, 2018 | 48 | 2018 |
| Connecting wettability, topography, and chemistry in a simple lipid-montmorillonite system BL Kessenich, N Pokhrel, E Nakouzi, CJ Newcomb, M Flury, L Maibaum, ... Journal of colloid and interface science 555, 498-508, 2019 | 8 | 2019 |
| Negatively charged lipids exhibit negligible effects on the water repellency of montmorillonite films BL Kessenich, N Pokhrel, JK Kibue, M Flury, L Maibaum, JJ De Yoreo ACS omega 5 (21), 12154-12161, 2020 | 2 | 2020 |
| Free Energy Calculation of Membrane Translocation: What Works When, and Why? N Pokhrel, L Maibaum Biomembrane Simulations, 125-144, 2019 | 1 | 2019 |
| Morphology of Lipid Aggregates on Clay Minerals and Connections to Macroscopic Wettability BL Kessenich, N Pokhrel, M Flury, L Maibaum, JJ De Yoreo Biophysical Journal 116 (3), 367a, 2019 | | 2019 |
| Using Committor and its Distribution to Assess the Convergence of Free Energy Calculations N Pokhrel, L Maibaum Biophysical Journal 116 (3), 144a, 2019 | | 2019 |
| Physicochemical Sources of Water Repellency in Lipid-Clay Films. B Kessenich, N Pokhrel, M Flury, L Maibaum, JJ De Yoreo SSSA International Soils Meeting (2019), 2019 | | 2019 |
| Understanding lipid membranes' interactions with small molecules and cholesterol using molecular dynamics computer simulations. N Pokhrel | | 2019 |
| Cholesterol Chemical Potential in Mixed Phosphatidylcholine/Cholesterol Bilayer: Model Predictions and Computer Simulations N Pokhrel, L Maibaum Biophysical Journal 114 (3), 601a, 2018 | | 2018 |
| Free Energy Calculation of Membrane Permeation-Simulation Results Suggest Relaxation of Headgroup-Solute Interactions is the Slowest Degree of Freedom N Pokhrel Biophysical Journal 112 (3), 229a, 2017 | | 2017 |
