Molecular Docking Simulations Through Gold Software for Nortopsentin-1,3,4-Oxadiazole Analogues

A new series of ten Nortopsentin-1,3,4-Oxadiazole analogues were designed, synthesized and in-silico screened for their molecular docking studies through GOLD software. The docking studies clearly presented the binding modes of the indole compounds in the active site of the colchicine binding site of the tubulin receptor. Among all selected compounds the 8a has higher binding affinity, before and after docking pose software.

Publication Details

Journal
Zenodo (CERN European Organization for Nuclear Research)
Published
2025-06-30
DOI
https://doi.org/10.5281/zenodo.15775574
Primary Topic
Gene expression and cancer classification
Type
article
Field-Weighted Citation Impact
0.00
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article

Molecular Docking Simulations Through Gold Software for Nortopsentin-1,3,4-Oxadiazole Analogues

Zenodo (CERN European Organization for Nuclear Research)
Gene expression and cancer classification
article

Molecular Docking Simulations Through Gold Software for Nortopsentin-1,3,4-Oxadiazole Analogues

article en

Abstract

A new series of ten Nortopsentin-1,3,4-Oxadiazole analogues were designed, synthesized and in-silico screened for their molecular docking studies through GOLD software. The docking studies clearly presented the binding modes of the indole compounds in the active site of the colchicine binding site of the tubulin receptor. Among all selected compounds the 8a has higher binding affinity, before and after docking pose software.

Zenodo (CERN European Organization for Nuclear Research)
Industry, innovation and infrastructure
Openalex Percentile: Top 55%
Gene expression and cancer classification
DOIOpen Access PDFOpenAlex
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Molecular Docking Simulations Through Gold Software for Nortopsentin-1,3,4-Oxadiazole Analogues · Zenodo (CERN European Organization for Nuclear Research) (2025) | TGRS Research Map | TGRS