Mini Review on Multivariate Linear Regression for
Homogeneous Catalysis

Farid Abu Shammala

Mini Review

Mini Review on Multivariate Linear Regression for Homogeneous Catalysis

Shashank Krishna R¹ and Pradeep Ilayaperumal^1,2*

¹Department of Chemistry, Bishop Heber College, India

²Department of Chemistry, Indian Institute of Technology Delhi, India

Corresponding Author

Received Date: June 11, 2021; Published Date: July 21, 2021

Abstract

The computational approaches are advantageous to the rational design of catalysts elucidating mechanistic insights, identifying active sites, and predicting catalytic activity. Here, the post-2018 short review on homogeneous catalysis, activation, and mechanistic approach using Multivariate Linear Regression (MLR) in DFT calculations.

Keywords: Multivariate Linear Regression (MLR); Selectivity prediction; Turn-over-frequency; Conformational analyses; Mechanistic analysis; DFT calculations

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