| Selectivity and mechanism of fengycin, an antimicrobial lipopeptide, from molecular dynamics S Sur, TD Romo, A Grossfield The Journal of Physical Chemistry B 122 (8), 2219-2226, 2018 | 98 | 2018 |
| Therapeutic enzyme engineering using a generative neural network A Giessel, A Dousis, K Ravichandran, K Smith, S Sur, I McFadyen, ... Scientific Reports 12, 2022 | 39 | 2022 |
| Ionizable amino lipids distribution and effects on DSPC/cholesterol membranes: implications for lipid nanoparticle structure S Dehghani-Ghahnaviyeh, M Smith, Y Xia, A Dousis, A Grossfield, S Sur The Journal of Physical Chemistry B 127 (31), 6928-6939, 2023 | 16 | 2023 |
| Effects of cholesterol on the mechanism of fengycin, a biofungicide S Sur, A Grossfield Biophysical journal 121 (10), 1963-1974, 2022 | 9 | 2022 |
| Understanding the function of the cyclic antifungal lipopeptide fengycin using all-atom Md simulation S Sur, A Grossfield Biophysical Journal 108 (2), 84a, 2015 | 3 | 2015 |
| Essential Considerations for Free Energy Calculations of RNA-Small Molecule Complexes: Lessons from Theophylline-Binding RNA Aptamer A Rasouli, FC Pickard IV, S Sur, A Grossfield, M Işık Bennett bioRxiv, 2024.08. 16.608304, 2024 | 1 | 2024 |
| Insights into the Mechanism of Fengycin, an Antimicrobial Lipopeptide using Multiscale Simulations S Sur, A Grossfield, TD Romo Biophysical Journal 110 (3), 76a, 2016 | 1 | 2016 |
| Interactions between ionizable amino lipids and a short RNA hairpin: Insights from molecular dynamics simulations for lipid nanoparticle optimization AJ Poruthoor, S Dehghanighahnaviyeh, SK Bali, M Isik, S Sur Biophysical Journal 123 (3), 97a, 2024 | | 2024 |
| Exploring the mechanism of the antifungal lipopeptide fengycin using molecular simulations S Sur, A Grossfield ABSTRACTS OF THE AMERICAN CHEMICAL SOCIETY MEETING, 2019 | | 2019 |
| Effects of Cholesterol on Fengycin, an Antimicrobial Lipopeptide Using Weighted Ensemble Path Sampling Method S Sur, A Grossfield Biophysical Journal 116 (3), 84a, 2019 | | 2019 |
| Membrane Selectivity of Fengycin, an Antimicrobial Lipopeptide S Sur University of Rochester, 2019 | | 2019 |
| Membrane Selectivity of an Antimicrobial Lipopeptide using Molecular Dynamics Simulations S Sur, A Grossfield Biophysical Journal 114 (3), 452a, 2018 | | 2018 |
Alan GrossfieldBiochemistry and Biophysics, University of Rochester Medical CenterEmail verificata su urmc.rochester.edu