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Local Interaction Density (LID), a Fast and Efficient Tool to Prioritize Docking Poses
Ligand docking at a protein site can be improved by prioritizing poses by similarity to validated binding modes found in the crystal structures of ligand/protein complexes. The interactions formed in the predicted model are searched in each of the reference 3D structures, taken individually. We prop...
Tallennettuna:
| Julkaisussa: | Molecules |
|---|---|
| Päätekijät: | , , , , |
| Aineistotyyppi: | Artigo |
| Kieli: | Inglês |
| Julkaistu: |
MDPI
2019
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| Aiheet: | |
| Linkit: | https://ncbi.nlm.nih.gov/pmc/articles/PMC6681060/ https://ncbi.nlm.nih.gov/pubmed/31323745 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.3390/molecules24142610 |
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