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MixMD Probeview: Robust Binding Site Prediction from Cosolvent Simulations
Mixed-solvent molecular dynamics (MixMD) is a cosolvent simulation technique for identifying binding hotspots and specific favorable interactions on a protein’s surface. MixMD studies have the ability to identify these biologically relevant sites by examining the occupancy of the cosolvent over the...
Wedi'i Gadw mewn:
| Cyhoeddwyd yn: | J Chem Inf Model |
|---|---|
| Prif Awduron: | , , |
| Fformat: | Artigo |
| Iaith: | Inglês |
| Cyhoeddwyd: |
2018
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| Pynciau: | |
| Mynediad Ar-lein: | https://ncbi.nlm.nih.gov/pmc/articles/PMC6186161/ https://ncbi.nlm.nih.gov/pubmed/29905479 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/acs.jcim.8b00265 |
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