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VFVS - VirtualFlow for Virtual ScreeningWelcome to the VirtualFlow project!VirtualFlow (Homepage) is a versatile, parallel workflow platform for carrying out virtual screening related tasks on Linux-based computer clusters of any type and size which are managed by a batchsystem (such as SLURM).Currently, there exist two versions of VirtualFlow, which are tailored to different types of tasks:VFLP: VirtualFlow for Ligand PreparationVFVS : VirtualFlow for Virtual ScreeningsThey use the same core technology regarding the workflow management and parallelization, and they can be used individually or in concert with each other. Additional versions are expected to arrive in the future. Pre-built ready-to-dock ligand libraries for VFVS are available for free (in the download section).Overview of ResourcesThe following gives an overview of the various resources related to VirtualFlow:Homepage of VirtualFlowThe documentation of VirtualFlowTutorials for VirtualFlowFeature Requests (powered by Canny)GitHub Issue Tracker for VFVSGitHub Issue Tracker for VFLPIn-code documentation of the source code filesContributingIf you are interested in contributing to VirtualFlow, whether it is to report a bug or to extend VirtualFlow with your own code, please see the file CONTRIBUTING.md and the file CODE_OF_CONDUCT.md.LicenseThe project ist distributed under the GNU GPL v2.0. Please see the file LICENSE for more details.CitationThe use of VirtualFlow or the VirtualFlow ligand libraries in any reports or publications should be acknowledged by including a citation to:Gorgulla, C., Boeszoermenyi, A., Wang, Z. et al. An open-source drug discovery platform enables ultra-large virtual screens. Nature (2020). https://doi.org/10.1038/s41586-020-2117-zVirtualFlow ForumIf you need help or have any questions related to VirtualFlow, please use our forum:https://community.virtual-flow.org/

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