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Fragment-based error estimation in biomolecular modeling
Computer simulations are becoming an increasingly more important component of drug discovery. Computational models are now often able to reproduce and sometimes even predict outcomes of experiments. Still, potential energy models such as force fields contain significant amounts of bias and imprecisi...
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| Autori principali: | , |
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| Natura: | Artigo |
| Lingua: | Inglês |
| Pubblicazione: |
2013
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| Soggetti: | |
| Accesso online: | https://ncbi.nlm.nih.gov/pmc/articles/PMC3947206/ https://ncbi.nlm.nih.gov/pubmed/23993915 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1016/j.drudis.2013.08.016 |
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