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Table 2 Virtual Screening results

From: Virtual screening, identification and experimental testing of novel inhibitors of PBEF1/Visfatin/NMPRTase for glioma therapy

 

#ligands

Energy cut-off

# ligands above cut-off

Cluster size cut-off

Potential ligands

   Maybridge HitFinder™

13214

< -8.5 kcal/mol

34

> 15

6

  1. Summary of docking results; (1) Docking of reference compounds to NMPRTase reproducing the crystal poses; (2) An overview of results of virtual screening to the same protein molecule.
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Journal of Clinical Bioinformatics

ISSN: 2043-9113