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In Silico Strategy for Targeting the mTOR Kinase at Rapamycin Binding Site by Small Molecules
Computer aided drug-design methods proved to be powerful tools for the identification of new therapeutic agents. We employed a structure-based workflow to identify new inhibitors targeting mTOR kinase at rapamycin binding site. By combining molecular dynamics (MD) simulation and pharmacophore modell...
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| Publicat a: | Molecules |
|---|---|
| Autors principals: | , , , , |
| Format: | Artigo |
| Idioma: | Inglês |
| Publicat: |
MDPI
2021
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| Matèries: | |
| Accés en línia: | https://ncbi.nlm.nih.gov/pmc/articles/PMC7922000/ https://ncbi.nlm.nih.gov/pubmed/33669763 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.3390/molecules26041103 |
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