Código QR (código de barras bidimensional)

Towards design of drugs and delivery systems with the Martini coarse-grained model

Coarse-grained (CG) modelling with the Martini force field has come of age. By combining a variety of bead types and sizes with a new mapping approach, the newest version of the model is able to accurately simulate large biomolecular complexes at millisecond timescales. In this perspective, we discu...

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Principais autores: Lisbeth R. Kjølbye, Gilberto P. Pereira, Alessio Bartocci, Martina Pannuzzo, Simone Albani, Alessandro Marchetto, Brian Jiménez-García, Juliette Martin, Giulia Rossetti, Marco Cecchini, Sangwook Wu, Luca Monticelli, Paulo C. T. Souza
Formato: Artigo
Idioma:Inglês
Publicado em: Cambridge University Press 2022-01-01
coleção:QRB Discovery
Assuntos:
coarse-grained models
molecular dynamics
Martini
drug design
drug delivery
cryptic pockets
transmembrane proteins
protein-protein interactions
soft delivery systems
PROTACS
lipid nanoparticles
Acesso em linha:https://www.cambridge.org/core/product/identifier/S2633289222000163/type/journal_article
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