Nalaganje...
Scoring and lessons learned with the CSAR benchmark using an improved iterative knowledge-based scoring function
Based on a statistical mechanics-based iterative method, we have extracted a set of distance-dependent, all-atom pairwise potentials for protein-ligand interactions from the crystal structures of 1300 protein-ligand complexes. The iterative method circumvents the long-standing reference state proble...
Shranjeno v:
| Main Authors: | , |
|---|---|
| Format: | Artigo |
| Jezik: | Inglês |
| Izdano: |
2011
|
| Teme: | |
| Online dostop: | https://ncbi.nlm.nih.gov/pmc/articles/PMC3190652/ https://ncbi.nlm.nih.gov/pubmed/21830787 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/ci2000727 |
| Oznake: |
Označite
Brez oznak, prvi označite!
|