Annual Review of Physical Chemistry · 1987 · 133 citations · 0 references
Natural SciencesChemistryPhysicsComputational ChemistryQuantum ChemistryTheoretical ChemistryAtomistic SimulationMolecular DynamicsMolecular ModelingMolecular Orbital TheoryMolecular Quantum MechanicsMolecular SimulationComputational Molecular ModelingElectronic Property PredictionMolecular Simulation AlgorithmsQuantum Molecular DynamicsRydberg FormulaRydberg MoleculesRydberg Quantum Simulation
Machine learning (ML) is transforming all areas of science. The complex and time-consuming calculations in molecular simulations are particularly suitable for an ML revolution and have already been profoundly affected by the application of existing ML ...Read More