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Mimicking Enzymes: Asymmetric Induction inside a Carbamate-Based Steroidal Cleft [2019]
Laplacian of the Hamiltonian Kinetic Energy Density as an Indicator of Binding and Weak Interactions [2019]
Intermolecular Singlet Fission in Unsymmetrical Derivatives of Pentacene in Solution [2019]
Individual precursors of student homework behavioral engagement: The role of intrinsic motivation, perceived homework utility and homework attitude [2019]
Hierarchies of quantum chemical descriptors induced by statistical analyses of domain occupation number operators [2019]
Fluorine conformational effects characterized by energy decomposition analysis [2019]
Exotic Bonding Regimes Uncovered in Excited States [2019]
Electron-pair bonding in real space. Is the charge-shift family supported? [2019]
Deciphering Limitations to Meet Highly Stable Bio-Hybrid Light-Emitting Diodes [2019]
Chemical Bonding from the Statistics of the Electron Distribution [2019]
Assessing the Reversed Exponential Decay of the Electrical Conductance in Molecular Wires: The Undeniable Effect of Static Electron Correlation [2019]
Anti-ohmic single molecule electron transport: is it feasible? [2019]
A first step towards quantum energy potentials of electron pairs [2019]
Affinity Calculations of Cyclodextrin Host-Guest Complexes: Assessment of Strengths and Weaknesses of End-Point Free Energy Methods [2019]
A chemical theory of topological insulators [2019]
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