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Combined Pharmacophore and Grid-Independent Molecular Descriptors (GRIND) Analysis to Probe 3D Features of Inositol 1,4,5-Trisphosphate Receptor (IP3R) Inhibitors in Cancer |
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| Authors: | Humaira Ismatullah Ishrat Jabeen |
| Affiliation: | Research Centre for Modelling and Simulation (RCMS), National University of Sciences and Technology (NUST), Sector H-12, Islamabad 44000, Pakistan; |
| Abstract: | |
| Keywords: | IP3R-mediated Ca2+ signaling IP3R modulators pharmacophore modeling virtual screening hits GRIND model PLS co-efficient correlogram |