Machine Learning of Semiempirical Parameters
![Machine Learning of Semiempirical Parameters](http://mlatom.com/wp-content/uploads/2018/05/ML-SQC-featured.jpg)
P. O. Dral, O. A. von Lilienfeld, W. Thiel, Machine Learning of Parameters for Accurate Semiempirical Quantum Chemical Calculations. J. Chem. Theory Comput. 2015, 11, 2120–2125.
AI-enhanced computational chemistry
P. O. Dral, O. A. von Lilienfeld, W. Thiel, Machine Learning of Parameters for Accurate Semiempirical Quantum Chemical Calculations. J. Chem. Theory Comput. 2015, 11, 2120–2125.
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