3-D-eChem VM: Cheminformatics Research Infrastructure in a Downloadable Virtual Machine

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Verhoeven, Stefan; Vass, Marton; de Esch, Iwan; Leurs, Rob; Lusher, Scott; Vriend, Gerrrit; Ritschel, Tina; de Graaf, Chris; McGuire, Ross;
  • Related identifiers: doi: 10.5281/zenodo.47208
  • Subject: Cheminformatics | KNIME | GPCR | KRIPO | Pharmacophore | Fingerprints

3D-e-Chem VM is a freely available Virtual Machine (VM) encompassing tools, databases & workflows, including new resources developed for ligand binding site comparisons and GPCR research. The VM contains a fully functional cheminformatics infrastructure consisting of a ... View more
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