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Conformational analysis of macrocycles: comparing general and specialized methods
ABSTRACT: Macrocycles represent an important class of medicinally relevant small molecules due to their interesting biological properties. Therefore, a firm understanding of their conformational preferences is important for drug design. Given the importance of macrocycle-protein modelling in drug di...
| Autores principales: | , , , |
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| Formato: | Online Artículo Texto |
| Lenguaje: | English |
| Publicado: |
Springer International Publishing
2020
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| Materias: | |
| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC7036058/ https://www.ncbi.nlm.nih.gov/pubmed/31965404 http://dx.doi.org/10.1007/s10822-020-00277-2 |