| Flexible simple point-charge water model with improved liquid-state properties Y Wu, HL Tepper, GA Voth The Journal of chemical physics 124 (2), 2006 | 1317 | 2006 |
| A multiscale coarse-graining method for biomolecular systems S Izvekov, GA Voth The Journal of Physical Chemistry B 109 (7), 2469-2473, 2005 | 1303 | 2005 |
| Uranyl extraction by N, N-dialkylamide ligands studied by static and dynamic DFT simulations MJ Frisch, GW Trucks, HB Schlegel, GE Scuseria, MA Robb, ... Gaussian 09, 2009 | 1078 | 2009 |
| Unique spatial heterogeneity in ionic liquids Y Wang, GA Voth Journal of the American Chemical Society 127 (35), 12192-12193, 2005 | 1076 | 2005 |
| The multiscale coarse-graining method. I. A rigorous bridge between atomistic and coarse-grained models WG Noid, JW Chu, GS Ayton, V Krishna, S Izvekov, GA Voth, A Das, ... The Journal of chemical physics 128 (24), 2008 | 940 | 2008 |
| Coarse-graining of condensed phase and biomolecular systems CRC Press, 2009 | 770* | 2009 |
| On the structure and dynamics of ionic liquids MG Del Pópolo, GA Voth The Journal of Physical Chemistry B 108 (5), 1744-1752, 2004 | 765 | 2004 |
| Multiscale coarse graining of liquid-state systems S Izvekov, GA Voth The Journal of chemical physics 123 (13), 2005 | 705 | 2005 |
| Promoting transparency and reproducibility in enhanced molecular simulations Nature methods 16 (8), 670-673, 2019 | 694 | 2019 |
| The computer simulation of proton transport in water UW Schmitt, GA Voth The Journal of chemical physics 111 (20), 9361-9381, 1999 | 671 | 1999 |
| The formulation of quantum statistical mechanics based on the Feynman path centroid density. II. Dynamical properties J Cao, GA Voth The Journal of chemical physics 100 (7), 5106-5117, 1994 | 625 | 1994 |
| Rigorous formulation of quantum transition state theory and its dynamical corrections GA Voth, D Chandler, WH Miller The Journal of chemical physics 91 (12), 7749-7760, 1989 | 610 | 1989 |
| Coarse-graining methods for computational biology MG Saunders, GA Voth Annual review of biophysics 42 (1), 73-93, 2013 | 599 | 2013 |
| Gaussian, Inc., Wallingford CT MJ Frisch, GW Trucks, HB Schlegel, GE Scuseria, MA Robb, ... Wallingford CT, 2009 | 582 | 2009 |
| Molecular dynamics simulation of nanostructural organization in ionic liquid/water mixtures W Jiang, Y Wang, GA Voth The Journal of Physical Chemistry B 111 (18), 4812-4818, 2007 | 534 | 2007 |
| Effective force fields for condensed phase systems from ab initio molecular dynamics simulation: A new method for force-matching S Izvekov, M Parrinello, CJ Burnham, GA Voth The Journal of chemical physics 120 (23), 10896-10913, 2004 | 526 | 2004 |
| Gaussian09 Revision D. 01, Gaussian Inc., Wallingford CT, 2009 MJ Frisch, GW Trucks, HB Schlegel, GE Scuseria, MA Robb, ... There is no corresponding record for this reference, 2015 | 517 | 2015 |
| Multiscale modeling of biomolecular systems: in serial and in parallel GS Ayton, WG Noid, GA Voth Current opinion in structural biology 17 (2), 192-198, 2007 | 514 | 2007 |
| Ab initio molecular dynamics: Propagating the density matrix with Gaussian orbitals. III. Comparison with Born–Oppenheimer dynamics HB Schlegel, SS Iyengar, X Li, JM Millam, GA Voth, GE Scuseria, ... The Journal of chemical physics 117 (19), 8694-8704, 2002 | 511 | 2002 |
| Multistate empirical valence bond model for proton transport in water UW Schmitt, GA Voth The Journal of Physical Chemistry B 102 (29), 5547-5551, 1998 | 480 | 1998 |
