piecewise-regression (aka segmented regression) in python. For fitting straight line models to data with one or more breakpoints where the gradient changes. APLR builds predictive, interpretable ...
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The Python Toolkit for Uncertainty Quantification (PyTUQ) is a Python-only collection of libraries and tools designed for quantifying uncertainty in computational models. PyTUQ offers a range of UQ ...
Quickly Calculating the Activity Coefficient of a NaCl Solution Based on Machine Learning Algorithms
School of Petroleum Engineering, Yangtze University, Wuhan City 430100, China Hubei Cooperative Innovation Center of Unconventional Oil & Gas, Yangtze University, Wuhan City 430100, China School of ...
Creative Commons (CC): This is a Creative Commons license. Attribution (BY): Credit must be given to the creator. Laser-induced fluorescence spectroscopy, Raman scattering, and partial least squares ...
We provide an introduction to Gaussian process regression (GPR) machine-learning methods in computational materials science and chemistry. The focus of the present review is on the regression of ...
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