| 1 |
A Classical Molecular Dynamics Simulation Study of Interfacial and Bulk Solution Aggregation Properties of Dirhamnolipids
Luft CM, Munusamy E, Pemberton JE, Schwartz SD
Journal of Physical Chemistry B, 124(5), 814, 2020 |
| 2 |
Mechanochemical Function of Myosin II: Investigation into the Recovery Stroke and ATP Hydrolysis
Baldo AP, Tardiff JC, Schwartz SD
Journal of Physical Chemistry B, 124(45), 10014, 2020 |
| 3 |
Role of Protein Motions in Catalysis by Formate Dehydrogenase
Antoniou D, Schwartz SD
Journal of Physical Chemistry B, 124(43), 9483, 2020 |
| 4 |
Optimization of the Turnover in Artificial Enzymes via Directed Evolution Results in the Coupling of Protein Dynamics to Chemistry
Schafer JW, Zoi I, Antoniou D, Schwartz SD
Journal of the American Chemical Society, 141(26), 10431, 2019 |
| 5 |
Molecular Dynamics Simulation of the Oil Sequestration Properties of a Nonionic Rhamnolipid
Luft CM, Munusamy E, Pemberton JE, Schwartz SD
Journal of Physical Chemistry B, 122(14), 3944, 2018 |
| 6 |
Unraveling the Differential Aggregation of Anionic and Nonionic Monorhamnolipids at Air-Water and Oil-Water Interfaces: A Classical Molecular Dynamics Simulation Study
Munusamy E, Luft CM, Pemberton JE, Schwartz SD
Journal of Physical Chemistry B, 122(24), 6403, 2018 |
| 7 |
Structural Properties of Nonionic Monorhamnolipid Aggregates in Water Studied by Classical Molecular Dynamics Simulations
Munusamy E, Luft CM, Pemberton JE, Schwartz SD
Journal of Physical Chemistry B, 121(23), 5781, 2017 |
| 8 |
Incorporating Fast Protein Dynamics into Enzyme Design: A Proposed Mutant Aromatic Amine Dehydrogenase
Zoi I, Antoniou D, Schwartz SD
Journal of Physical Chemistry B, 121(30), 7290, 2017 |
| 9 |
Evolution of Aggregate Structure in Solutions of Anionic Monorhamnolipids: Experimental and Computational Results
Eismin RJ, Munusamy E, Kegel LL, Hogan DE, Maier RM, Schwartz SD, Pemberton JE
Langmuir, 33(30), 7412, 2017 |
| 10 |
Phase Space Bottlenecks in Enzymatic Reactions
Antoniou D, Schwartz SD
Journal of Physical Chemistry B, 120(3), 433, 2016 |
