1 |
Molecular Dynamics Simulations Based on Newly Developed Force Field Parameters for Cu2+ Spin Labels Provide Insights into Double-Histidine-Based Double Electron-Electron Resonance Bogetti X, Ghosh S, Jarvi AG, Wang JM, Saxena S Journal of Physical Chemistry B, 124(14), 2788, 2020 |
2 |
Development of Cu2+-Based Distance Methods and Force Field Parameters for the Determination of PNA Conformations and Dynamics by EPR and MD Simulations Jarvi AG, Sargun A, Bogetti X, Wang JM, Achim C, Saxena S Journal of Physical Chemistry B, 124(35), 7544, 2020 |
3 |
Designing Open Metal Sites in Metal Organic Frameworks for Paraffin/Olefin Separations Mohamed MH, Yang YH, Li L, Zhang S, Ruffley JP, Jarvi AG, Saxena S, Veser G, Johnson JK, Rosi NL Journal of the American Chemical Society, 141(33), 13003, 2019 |
4 |
On the Use of Q-Band Double Electron-Electron Resonance To Resolve the Relative Orientations of Two Double Histidine-Bound Cu2+ Ions in a Protein Jarvi AG, Ranguelova K, Ghosh S, Weber RT, Saxena S Journal of Physical Chemistry B, 122(47), 10669, 2018 |
5 |
Programmable Topology in New Families of Heterobimetallic Metal- Organic Frameworks Muldoon PF, Liu C, Miller CC, Koby SB, Jarvi AG, Luo TY, Saxena S, O'Keeffe M, Rosi NL Journal of the American Chemical Society, 140(20), 6194, 2018 |