Llwytho...
Assessment of conformational ensemble sizes necessary for specific resolutions of coverage of conformational space
The size of conformational ensembles required for regular coverage of the conformational space of drug-like molecules was examined. Using the conformer generation program Omega, the number of regularly-distributed conformers (NRC) of flexible compounds was determined as a function of the root mean s...
Wedi'i Gadw mewn:
| Prif Awduron: | , , , |
|---|---|
| Fformat: | Artigo |
| Iaith: | Inglês |
| Cyhoeddwyd: |
2007
|
| Pynciau: | |
| Mynediad Ar-lein: | https://ncbi.nlm.nih.gov/pmc/articles/PMC2040338/ https://ncbi.nlm.nih.gov/pubmed/17569521 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/ci7000956 |
| Tagiau: |
Ychwanegu Tag
Dim Tagiau, Byddwch y cyntaf i dagio'r cofnod hwn!
|