Application of InterCriteria Analysis to Assess the Performance of Scoring Functions in Molecular Docking Software Packages

Application of InterCriteria Analysis to Assess the Performance of Scoring Functions in Molecular Docking Software Packages

(1) Background: <i>In silico</i> approaches to rational drug design are among the fastest evolving ones. Depending on the available structural information for the biomacromolecule and the small molecule, the <i>in silico</i> methods are classified as ligand- and structure-bas...

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Main Authors: Dessislava Jereva, Petko Alov, Ivanka Tsakovska, Maria Angelova, Vassia Atanassova, Peter Vassilev, Nikolay Ikonomov, Krassimir Atanassov, Ilza Pajeva, Tania Pencheva
Format: Article
Language:English
Published: MDPI AG 2022-07-01
Series:Mathematics
Subjects:
InterCriteria analysis
molecular docking
scoring function
decision making
Online Access:https://www.mdpi.com/2227-7390/10/15/2549

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https://www.mdpi.com/2227-7390/10/15/2549

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