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FABP4 inhibitors 3D-QSAR model and isosteric replacement of BMS309403 datasets
The data have been obtained from FABP4 inhibitor molecules previously published. The 120 compounds were used to build a 3D-QSAR model. The development of the QSAR model has been undertaken with the use of Forge software using the PM3 optimized structure and the experimental IC(50) of each compound....
| Autores principales: | , , , , , |
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| Formato: | Online Artículo Texto |
| Lenguaje: | English |
| Publicado: |
Elsevier
2018
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| Materias: | |
| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6312796/ https://www.ncbi.nlm.nih.gov/pubmed/30619925 http://dx.doi.org/10.1016/j.dib.2018.12.047 |