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BMC Bioinformatics|March 29, 2007
Discovering structural motifs using a structural alphabet: application to magnesium-binding sitesMinko Dudev, Carmay LimThe Journal of Physical Chemistry. B|August 27, 2009
Factors governing metal-ligand distances and coordination geometries of metal complexesGopi Kuppuraj, Minko Dudev, Carmay LimThe Journal of Physical Chemistry. B|February 14, 2006
Factors governing the metal coordination number in metal complexes from Cambridge Structural Database analysesMinko Dudev, Jonathan Wang, Todor Dudev, et al.Journal of the American Chemical Society|March 6, 2003
First-second shell interactions in metal binding sites in proteins: a PDB survey and DFT/CDM calculationsTodor Dudev, Yen-lin Lin, Minko Dudev, et al.Journal of the American Chemical Society|August 19, 2004
Oxyanion selectivity in sulfate and molybdate transport proteins: an ab initio/CDM studyTodor Dudev, Carmay LimJournal of the American Chemical Society|February 2, 2006
A DFT/CDM Study of metal-carboxylate interactions in metalloproteins: factors governing the maximum number of metal-bound carboxylatesTodor Dudev, Carmay LimJournal of the American Chemical Society|February 13, 2014
Evolution of eukaryotic ion channels: principles underlying the conversion of Ca²⁺-selective to Na⁺-selective channelsTodor Dudev, Carmay LimJournal of the American Chemical Society|September 22, 2007
All-electron calculations of the nucleation structures in metal-induced zinc-finger folding: role of the Peptide backboneTodor Dudev, Carmay LimThe Journal of Physical Chemistry. A|February 21, 2007
Polarization-consistent versus correlation-consistent basis sets in predicting molecular and spectroscopic propertiesTeobald Kupka, Carmay LimJournal of the American Chemical Society|May 22, 2009
Determinants of K+ vs Na+ selectivity in potassium channelsTodor Dudev, Carmay LimPageof 13