Abstract
By a News Reporter-Staff News Editor at Robotics & Machine Learning Daily News Daily News – Researchers detail new data in Machine Learning. According to news reporting from Richmond, Virginia, by NewsRx journa lists, research stated, “In this study, we introduce SAPT10K, a comprehensive da taset comprising 9982 noncovalent interaction energies and their binding energy components (electrostatics, exchange, induction, and dispersion) for diverse int ermolecular complexes of 944 unique dimers. These complexes cover significant po rtions of the intermolecular potential energy surface and were computed using hi gher-order symmetry-adapted perturbation theory, SAPT2+(3)(CCD), with a large au g-cc-pVTZ basis set.” Funders for this research include American Chemical Society, American Chemical S ociety, VCU Graduate School Dissertation Assistantship.
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