Carregant...

Computer Simulations of the Dissociation Mechanism of Gleevec from Abl Kinase with Milestoning

Gleevec (a.k.a., imatinib) is an important anti-cancer (e.g., chronic myeloid leukemia) chemotherapeutic drug due to its inhibitory interaction with the Abl kinase. Here, we use atomically detailed simulations within the Milestoning framework to study the molecular dissociation mechanism of Gleevec...

Descripció completa

Guardat en:
Dades bibliogràfiques
Publicat a:J Phys Chem B
Autors principals: Narayan, Brajesh, Buchete, Nicolae-Viorel, Elber, Ron
Format: Artigo
Idioma:Inglês
Publicat: 2021
Matèries:
Accés en línia:https://ncbi.nlm.nih.gov/pmc/articles/PMC8192492/
https://ncbi.nlm.nih.gov/pubmed/33930271
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/acs.jpcb.1c00264
Etiquetes: Afegir etiqueta
Sense etiquetes, Sigues el primer a etiquetar aquest registre!