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Thermodynamics and Kinetics of Drug-Target Binding by Molecular Simulation

[Image: see text] Computational studies play an increasingly important role in chemistry and biophysics, mainly thanks to improvements in hardware and algorithms. In drug discovery and development, computational studies can reduce the costs and risks of bringing a new medicine to market. Computation...

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Detalhes bibliográficos
Publicado no:Chem Rev
Main Authors: Decherchi, Sergio, Cavalli, Andrea
Formato: Artigo
Idioma:Inglês
Publicado em: American Chemical Society 2020
Acesso em linha:https://ncbi.nlm.nih.gov/pmc/articles/PMC8011912/
https://ncbi.nlm.nih.gov/pubmed/33006893
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/acs.chemrev.0c00534
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