| Principles governing Mg, Ca, and Zn binding and selectivity in proteins T Dudev, C Lim Chemical reviews 103 (3), 773-788, 2003 | 532 | 2003 |
| Absolute pKa calculations with continuum dielectric methods C Lim, D Bashford, M Karplus The Journal of Physical Chemistry 95 (14), 5610-5620, 1991 | 497 | 1991 |
| Competition among metal ions for protein binding sites: determinants of metal ion selectivity in proteins T Dudev, C Lim Chemical reviews 114 (1), 538-556, 2014 | 430 | 2014 |
| How molecular size impacts RMSD applications in molecular dynamics simulations K Sargsyan, C Grauffel, C Lim Journal of chemical theory and computation 13 (4), 1518-1524, 2017 | 385 | 2017 |
| Ring strain energies from ab initio calculations T Dudev, C Lim Journal of the American Chemical Society 120 (18), 4450-4458, 1998 | 289 | 1998 |
| Metal binding affinity and selectivity in metalloproteins: insights from computational studies T Dudev, C Lim Annu. Rev. Biophys. 37 (1), 97-116, 2008 | 276 | 2008 |
| Tetrahedral vs octahedral zinc complexes with ligands of biological interest: a DFT/CDM study T Dudev, C Lim Journal of the American Chemical Society 122 (45), 11146-11153, 2000 | 270 | 2000 |
| First− second shell interactions in metal binding sites in proteins: A PDB survey and DFT/CDM calculations T Dudev, Lin, M Dudev, C Lim Journal of the American Chemical Society 125 (10), 3168-3180, 2003 | 233 | 2003 |
| Competitive binding in magnesium coordination chemistry: water versus ligands of biological interest T Dudev, JA Cowan, C Lim Journal of the American Chemical Society 121 (33), 7665-7673, 1999 | 185 | 1999 |
| Empirical force fields for biologically active divalent metal cations in water CS Babu, C Lim The Journal of Physical Chemistry A 110 (2), 691-699, 2006 | 175 | 2006 |
| Zn protein simulations including charge transfer and local polarization effects DV Sakharov, C Lim Journal of the American Chemical Society 127 (13), 4921-4929, 2005 | 171 | 2005 |
| Theory of ionic hydration: Insights from molecular dynamics simulations and experiment CS Babu, C Lim The Journal of Physical Chemistry B 103 (37), 7958-7968, 1999 | 171 | 1999 |
| Factors governing the metal coordination number in metal complexes from Cambridge Structural Database analyses M Dudev, J Wang, T Dudev, C Lim The Journal of Physical Chemistry B 110 (4), 1889-1895, 2006 | 161 | 2006 |
| Monodentate versus bidentate carboxylate binding in magnesium and calcium proteins: what are the basic principles? T Dudev, C Lim The Journal of Physical Chemistry B 108 (14), 4546-4557, 2004 | 150 | 2004 |
| Effect of carboxylate-binding mode on metal binding/selectivity and function in proteins T Dudev, C Lim Accounts of chemical research 40 (1), 85-93, 2007 | 145 | 2007 |
| Free energy decomposition of protein-protein interactions SY Noskov, C Lim Biophysical journal 81 (2), 737-750, 2001 | 139 | 2001 |
| Physical basis of structural and catalytic Zn-binding sites in proteins Y Lee, C Lim Journal of molecular biology 379 (3), 545-553, 2008 | 131 | 2008 |
| An azido-BODIPY probe for glycosylation: initiation of strong fluorescence upon triazole formation JJ Shie, YC Liu, YM Lee, C Lim, JM Fang, CH Wong Journal of the American Chemical Society 136 (28), 9953-9961, 2014 | 127 | 2014 |
| Factors governing metal− ligand distances and coordination geometries of metal complexes G Kuppuraj, M Dudev, C Lim The journal of physical chemistry B 113 (9), 2952-2960, 2009 | 127 | 2009 |
| Atom–surface scattering dynamics at hyperthermal energies A Amirav, MJ Cardillo, PL Trevor, C Lim, JC Tully The Journal of chemical physics 87 (3), 1796-1807, 1987 | 127 | 1987 |
