Please use this identifier to cite or link to this item: http://localhost:8080/xmlui/handle/123456789/4418
Title: AFFINITY PREDICTION USING MUTATED PROTEIN-LIGAND DOCKING WITH REGRESSION TECHNIQUES OF SCA
Authors: Asha, P R
Vijaya, M S
Keywords: Docking
Kernels
Linear Regression
Ligand
Mutation
Neural Network Regression
Numpy
Polynomial Regression
Issue Date: Jul-2019
Publisher: Blue Eyes Intelligence Engineering & Sciences Publication
Abstract: Drug discovery for rare genetic disorder like spinocerebellar ataxia is very complicated in biomedical research. Numerous approaches are available for drug design in clinical labs, but it is time consuming. There is a need for affinity prediction of spinocerebellar ataxia, which will help in facilitating the drug design. In this work, the proteins are mutated with the information available from HGMD database. The repeat mutations are induced manually, and that mutated proteins are docked with ligand. The model is trained with extricated features such as energy profiles, rf-score, autodock vina scores, cyscore and sequence descriptors. Regression techniques like linear, polynomial, ridge, SVM and neural network regression are implemented. The predictive models are built with various regression techniques and the predictive model implemented with support vector regression is compared with support vector regression kernel. Among all regression techniques, SVR performs well than the other regression models.
URI: https://www.ijrte.org/wp-content/uploads/papers/v8i2/B1678078219.pdf
ISSN: 2277-3878
Appears in Collections:2.Article (73)

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