Wordt geladen...
Comparison of affinity ranking using AutoDock-GPU and MM-GBSA scores for BACE-1 inhibitors in the D3R Grand Challenge 4
Molecular docking has been successfully used in computer-aided molecular design projects for the identification of ligand poses within protein binding sites. However, relying on docking scores to rank different ligands with respect to their experimental affinities might not be sufficient. It is beli...
Bewaard in:
| Gepubliceerd in: | J Comput Aided Mol Des |
|---|---|
| Hoofdauteurs: | , , , , , , , , , |
| Formaat: | Artigo |
| Taal: | Inglês |
| Gepubliceerd in: |
2019
|
| Onderwerpen: | |
| Online toegang: | https://ncbi.nlm.nih.gov/pmc/articles/PMC7027993/ https://ncbi.nlm.nih.gov/pubmed/31691919 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1007/s10822-019-00240-w |
| Tags: |
Voeg label toe
Geen labels, Wees de eerste die dit record labelt!
|