| 1 |
Structure and Dynamics of DNA and RNA Double Helices Obtained from the CCG and GGC Trinucleotide Repeats
Pan F, Man VH, Roland C, Sagui C
Journal of Physical Chemistry B, 122(16), 4491, 2018 |
| 2 |
Classical Electrostatics for Biomolecular Simulations
Cisneros GA, Karttunen M, Ren PY, Sagui C
Chemical Reviews, 114(1), 779, 2014 |
| 3 |
Classical Electrostatics for Biomolecular Simulations (vol 114, pg 779, 2014)
Cisneros GA, Karttunen M, Ren PY, Sagui C
Chemical Reviews, 114(9), 5116, 2014 |
| 4 |
The gp41(659-671) HIV-1 Antibody Epitope: A Structurally Challenging Small Peptide
Zhang Y, Sagui C
Journal of Physical Chemistry B, 118(1), 69, 2014 |
| 5 |
Calculating relative transition rates with driven nonequilibrium simulations
Moradi M, Sagui C, Roland C
Chemical Physics Letters, 518, 109, 2011 |
| 6 |
PPII Propensity of Multiple-Guest Amino Acids in a Proline-Rich Environment
Moradi M, Babin V, Sagui C, Roland C
Journal of Physical Chemistry B, 115(26), 8645, 2011 |
| 7 |
Deprotonation of solvated formic acid: Car-Parrinello and metadynamics simulations
Lee JG, Asciutto E, Babin V, Sagui C, Darden T, Roland C
Journal of Physical Chemistry B, 110(5), 2325, 2006 |
| 8 |
Molecular dynamics simulations of DNA with polarizable force fields: Convergence of an ideal B-DNA structure to the crystallographic structure
Babin V, Baucom J, Darden TA, Sagui C
Journal of Physical Chemistry B, 110(23), 11571, 2006 |
| 9 |
Exploring intramolecular reactions in complex systems with metadynamics: The case of the malonate anions
Asciutto E, Sagui C
Journal of Physical Chemistry A, 109(34), 7682, 2005 |
| 10 |
Quantum simulations of the structure and binding of glycopeptide antibiotic aglycons to cell wall analogues
Lee JG, Sagui C, Roland C
Journal of Physical Chemistry B, 109(43), 20588, 2005 |
