| Structure of the key species in the enzymatic oxidation of methane to methanol | Nature | 2015 | 198 |
| Systematic Parameterization of Monovalent Ions Employing the Nonbonded Model | Journal of Chemical Theory and Computation | 2015 | 195 |
| Parameterization of highly charged metal ions using the 12-6-4 LJ-type nonbonded model in explicit water | Journal of Physical Chemistry B | 2015 | 150 |
| Spectrum-Dependent Spiro-OMeTAD Oxidization Mechanism in Perovskite Solar Cells | ACS Applied Materials & Interfaces | 2015 | 127 |
| Catalytic Synthesis of 2H-Chromenes | ACS Catalysis | 2015 | 119 |
| The potential versus current state of water splitting with hematite | Physical Chemistry Chemical Physics | 2015 | 118 |
| Coating of Nafion membranes with polyelectrolyte multilayers to achieve high monovalent/divalent cation electrodialysis selectivities | ACS Applied Materials & Interfaces | 2015 | 117 |
| A survey of catalysts for aromatics from fast pyrolysis of biomass | Applied Catalysis B: Environmental | 2015 | 112 |
| Rapid and comprehensive 'shotgun' lipidome profiling of colorectal cancer cell derived exosomes | Methods | 2015 | 108 |
| Titanium-catalyzed multicomponent couplings: efficient one-pot syntheses of nitrogen heterocycles | Accounts of Chemical Research | 2015 | 108 |
| GENESIS: a hybrid-parallel and multi-scale molecular dynamics simulator with enhanced sampling algorithms for biomolecular and cellular simulations | Wiley Interdisciplinary Reviews: Computational Molecular Science | 2015 | 107 |
| Effects-Directed Analysis of Dissolved Organic Compounds in Oil Sands Process-Affected Water | Environmental Science & Technology | 2015 | 104 |
| The regulation of photosynthetic structure and function during nitrogen deprivation in Chlamydomonas reinhardtii | Plant Physiology | 2015 | 80 |
| Functionally divergent alleles and duplicated Loci encoding an acyltransferase contribute to acylsugar metabolite diversity in Solanum trichomes | Plant Cell | 2015 | 76 |
| METALLOPROTEINS. A tethered niacin-derived pincer complex with a nickel-carbon bond in lactate racemase | Science | 2015 | 74 |
| Electrocatalytic upgrading of model lignin monomers with earth abundant metal electrodes | Green Chemistry | 2015 | 73 |
| Electrolysis of liquid ammonia for hydrogen generation | Energy and Environmental Science | 2015 | 65 |
| Student Understanding of Intermolecular Forces: A Multimodal Study | Journal of Chemical Education | 2015 | 65 |
| Ruthenium nanoparticles loaded on multiwalled carbon nanotubes for liquid-phase hydrogenation of fine chemicals: An exploration of confinement effect | Journal of Catalysis | 2015 | 65 |
| Organophosphorus insecticides in honey, pollen and bees (Apis mellifera L.) and their potential hazard to bee colonies in Egypt | Ecotoxicology and Environmental Safety | 2015 | 63 |
| Why Ask Why? | Journal of Chemical Education | 2015 | 60 |
| Nanoscale multireference quantum chemistry: full configuration interaction on graphical processing units | Journal of Chemical Theory and Computation | 2015 | 59 |
| Amorphous V2O5-P2O5 as high-voltage cathodes for magnesium batteries | Chemical Communications | 2015 | 51 |
| Simulated evolution of fluorophores for light emitting diodes | Journal of Chemical Physics | 2015 | 50 |
| A Feedback-Insensitive Isopropylmalate Synthase Affects Acylsugar Composition in Cultivated and Wild Tomato | Plant Physiology | 2015 | 50 |
