Molecular dynamics simulations of DNA/PEI complexes: effect of PEI branching and protonation state C Sun, T Tang, H Uludağ, JE Cuervo Biophysical journal 100 (11), 2754-2763, 2011 | 158 | 2011 |
Path integral ground state with a fourth-order propagator: Application to condensed helium JE Cuervo, PN Roy, M Boninsegni The Journal of chemical physics 122 (11), 2005 | 115 | 2005 |
Path integral ground state study of finite-size systems: Application to small (parahydrogen) N (N= 2–20) clusters JE Cuervo, PN Roy The Journal of chemical physics 125 (12), 2006 | 97 | 2006 |
On the solid-and liquidlike nature of quantum clusters in their ground state JE Cuervo, PN Roy The Journal of chemical physics 128 (22), 2008 | 55 | 2008 |
The structural pathway for water permeation through sodium-glucose cotransporters LJ Sasseville, JE Cuervo, JY Lapointe, SY Noskov Biophysical journal 101 (8), 1887-1895, 2011 | 42 | 2011 |
Weakly bound complexes trapped in quantum matrices: Structure, energetics, and isomer coexistence in (para-H2) N (ortho-D2) 3 clusters JE Cuervo, PN Roy The Journal of chemical physics 131 (11), 2009 | 33 | 2009 |
A guide to QM/MM methodology and applications R Zhang, B Lev, JE Cuervo, SY Noskov, DR Salahub Adv. Quantum Chem 59, 353-400, 2010 | 31 | 2010 |
Atomistic models of ion and solute transport by the sodium-dependent secondary active transporters I Zdravkovic, C Zhao, B Lev, JE Cuervo, SY Noskov Biochimica et Biophysica Acta (BBA)-Biomembranes 1818 (2), 337-347, 2012 | 26 | 2012 |
The role of H-bonding in the structure of the 4-piperidinecarboxylic acid monohydrate AJ Mora, G Delgado, BM Ramı́rez, L Rincón, R Almeida, J Cuervo, ... Journal of molecular structure 615 (1-3), 201-208, 2002 | 22 | 2002 |
Ab Initio Potential Energy and Dipole Moment Surfaces for CS2: Determination of Molecular Vibrational Energies E Pradhan, JL Carreon-Macedo, JE Cuervo, M Schröder, A Brown The Journal of Physical Chemistry A 117 (32), 6925-6931, 2013 | 21 | 2013 |
Effect of confinement on DNA, solvent and counterion dynamics in a model biological nanopore S Markosyan, PM De Biase, L Czapla, O Samoylova, G Singh, J Cuervo, ... Nanoscale 6 (15), 9006-9016, 2014 | 20 | 2014 |
Quantum mechanical treatment of binding energy between DNA nucleobases and carbon nanotube: A DFT analysis MC Amirani, T Tang, J Cuervo Physica E: Low-dimensional Systems and Nanostructures 54, 65-71, 2013 | 20 | 2013 |
Density functional study of benzene adsorption on the α-Mo2C(0001) surface B Zhou, X Liu, J Cuervo, DR Salahub Structural Chemistry 23, 1459-1466, 2012 | 18 | 2012 |
On the energetic and structure of 2-piperidinic acid J Cuervo, L Rincón, R Almeida, AJ Mora, G Delgado, A Bahsas Journal of molecular structure 615 (1-3), 191-199, 2002 | 14 | 2002 |
Towards nanopore sequencing: in-silico studies on the interactions between alpha-hemolysin and SS DNA molecules S Markosyan, JE Cuervo, S Noskov Biophysical Journal 104 (2), 334a, 2013 | 2 | 2013 |
Ground state properties of pure and doped quantum clusters J Cuervo | 1 | 2008 |
Multiscale modeling of the structure and thermodynamics of chemically modified NCC for rational design of NCC-based nanocomposites, gels, and foams SR Stoyanov, O Lyubimova, JE Cuervo, S Gusarov, AE Kobryn, N Blinov, ... TAPPI International Conference on Nanotechnology for Renewable Materials …, 2012 | | 2012 |
Molecular determinants of selective solute binding and transport in membrane proteins C Zhao, J Cuervo, B Lev, S Noskov ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY 241, 2011 | | 2011 |
Transporting Mechanisms of Sodium-Dependent Secondary Membrane Transporters: Insights form Computational Simulations C Zhao, J Cuervo, SY Noskov Biophysical Journal 100 (3), 412a, 2011 | | 2011 |
WEAKLY BOUND QUANTUM CLUSTERS AT ULTRA LOW TEMPERATURES: RIGID OR LIQUID? PN ROY, J Cuervo, M Boninsegni | | 2007 |