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Simulation-based cheminformatic analysis of organelle-targeted molecules: lysosomotropic monobasic amines
Cell-based molecular transport simulations are being developed to facilitate exploratory cheminformatic analysis of virtual libraries of small drug-like molecules. For this purpose, mathematical models of single cells are built from equations capturing the transport of small molecules across membran...
| Autores principales: | , , |
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| Formato: | Texto |
| Lenguaje: | English |
| Publicado: |
Springer Netherlands
2008
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| Materias: | |
| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2516532/ https://www.ncbi.nlm.nih.gov/pubmed/18338229 http://dx.doi.org/10.1007/s10822-008-9194-7 |