Probing the impact of protein and ligand preparation procedures on chemotype enrichment in structure-based virtual screening using DEKOIS 2.0 benchmark sets.

scientific article published on 11 March 2014

Details

Instance of: scholarly conference abstract
Publication date: 11 March 2014
Author: Frank M. Boeckler, Matthias Bauer
Main subject: virtual screening, chemotype
author name string: Tamer M Ibrahim
cites work: Evaluation and Optimization of Virtual Screening Workflows with DEKOIS 2.0 – A Public Library of Challenging Docking Benchmark Sets, DEKOIS: Demanding Evaluation Kits for Objective in Silico Screening — A Versatile Tool for Benchmarking Docking Programs and Scoring Functions
copyright license: Creative Commons Attribution 4.0 International
copyright status: copyrighted
issue: Suppl 1
page(s): P19-P19
published in: Journal of Cheminformatics
title: Probing the impact of protein and ligand preparation procedures on chemotype enrichment in structure-based virtual screening using DEKOIS 2.0 benchmark sets
volume: 6

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