Cargando…
Rapid assessment of conformational preferences in biaryl and aryl carbonyl fragments
The ability to rapidly assess the preferred conformation of key fragments in a structure “by visual inspection” is a very useful starting point in the process of drug design. With the ability to do so, one could address questions like: “How could we avoid planarity in a molecule?”, “Will a molecule...
| Autores principales: | , |
|---|---|
| Formato: | Online Artículo Texto |
| Lenguaje: | English |
| Publicado: |
Public Library of Science
2018
|
| Materias: | |
| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5851544/ https://www.ncbi.nlm.nih.gov/pubmed/29538410 http://dx.doi.org/10.1371/journal.pone.0192974 |