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Journal of Chemical Theory and Computation|November 25, 2015
Toward a Unique Definition of the Local SpinEloy Ramos-Cordoba, Eduard Matito, István Mayer, et al.Journal of Chemical Theory and Computation|November 25, 2015
Suitability of the MARTINI Force Field for Use with Gas-Phase Protein ComplexesSarah K Fegan, Mark ThachukJournal of Chemical Theory and Computation|November 25, 2015
Reaction Event Counting Statistics of Biopolymer Reaction Systems with Dynamic HeterogeneityYu Rim Lim, Seong Jun Park, Bo Jung Park, et al.Journal of Chemical Theory and Computation|November 25, 2015
Improving the Efficiency of Protein-Ligand Binding Free-Energy Calculations by System TruncationSamuel Genheden, Ulf RydeJournal of Chemical Theory and Computation|November 25, 2015
Construction of the Free Energy Landscape of Peptide Aggregation from Molecular Dynamics SimulationsLaura Riccardi, Phuong H Nguyen, Gerhard StockJournal of Chemical Theory and Computation|November 25, 2015
Locality and Fluctuations: Trends in Imidazolium-Based Ionic Liquids and BeyondKatharina Wendler, Stefan Zahn, Florian Dommert, et al.Journal of Chemical Theory and Computation|November 25, 2015
Recursive Taylor Series Expansion Method for Rigid-Body Molecular DynamicsAlexey V Akimov, Anatoly B KolomeiskyJournal of Chemical Theory and Computation|November 25, 2015
Quantum Electrodynamics Effects in Rovibrational Spectra of Molecular HydrogenJacek Komasa, Konrad Piszczatowski, Grzegorz Łach, et al.Journal of Chemical Theory and Computation|November 25, 2015
Correlation Energy Expressions from the Adiabatic-Connection Fluctuation-Dissipation Theorem ApproachJános G Ángyán, Ru-Fen Liu, Julien Toulouse, et al.Journal of Chemical Theory and Computation|November 25, 2015
Magnetic Properties of Ni(2+)(aq) from First PrinciplesJiří Mareš, Helmi Liimatainen, Teemu O Pennanen, et al.Pageof 1,139