Cargando…
Application of 3D Zernike descriptors to shape-based ligand similarity searching
BACKGROUND: The identification of promising drug leads from a large database of compounds is an important step in the preliminary stages of drug design. Although shape is known to play a key role in the molecular recognition process, its application to virtual screening poses significant hurdles bot...
| Autores principales: | , , |
|---|---|
| Formato: | Texto |
| Lenguaje: | English |
| Publicado: |
Springer
2009
|
| Materias: | |
| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2820497/ https://www.ncbi.nlm.nih.gov/pubmed/20150998 http://dx.doi.org/10.1186/1758-2946-1-19 |