<![CDATA[BOL: vsFilt: A tool to improve virtual screening by structural filtration of docking poses]]> https://bioinformaticsonline.com/bookmarks/view/42354/vsfilt-a-tool-to-improve-virtual-screening-by-structural-filtration-of-docking-poses? https://bioinformaticsonline.com/bookmarks/view/42354/vsfilt-a-tool-to-improve-virtual-screening-by-structural-filtration-of-docking-poses Wed, 25 Nov 2020 02:39:16 -0600 https://bioinformaticsonline.com/bookmarks/view/42354/vsfilt-a-tool-to-improve-virtual-screening-by-structural-filtration-of-docking-poses <![CDATA[vsFilt: A tool to improve virtual screening by structural filtration of docking poses]]> The vsFilt is the first open application for post-docking structural filtration, available as a web-server. The new tool is easy to use and configure to detect a wide range of interaction types that are known to be involved in molecular recognition, including hydrogen and halogen bonds, ionic interactions, hydrophobic contacts, π-stacking, and cation-π interactions. The web-server can process large libraries of up to 150’000 docked ligand poses. The results are web-based and can be operated on-line using the built-in HTML5 interactive analysis tools, or can be downloaded for a local use. The vsFilt is freely available on-line, no login required.

Address of the bookmark: https://biokinet.belozersky.msu.ru/vsfilt

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