Cargando…
Prediction of kinase-inhibitor binding affinity using energetic parameters
The combination of physicochemical properties and energetic parameters derived from protein-ligand complexes play a vital role in determining the biological activity of a molecule. In the present work, protein-ligand interaction energy along with logP values was used to predict the experimental log...
| Autores principales: | , |
|---|---|
| Formato: | Online Artículo Texto |
| Lenguaje: | English |
| Publicado: |
Biomedical Informatics
2016
|
| Materias: | |
| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5267961/ https://www.ncbi.nlm.nih.gov/pubmed/28149052 http://dx.doi.org/10.6026/97320630012172 |