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Search for Novel Lead Inhibitors of Yeast Cytochrome bc1, from Drugbank and COCONUT
In this work we introduce a novel filtering and molecular modeling pipeline based on a fingerprint and descriptor similarity procedure, coupled with molecular docking and molecular dynamics (MD), to select potential novel quoinone outside inhibitors (QoI) of cytochrome bc1 with the aim of determinin...
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| 出版年: | Molecules |
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| 主要な著者: | , |
| フォーマット: | Artigo |
| 言語: | Inglês |
| 出版事項: |
MDPI
2021
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| 主題: | |
| オンライン･アクセス: | https://ncbi.nlm.nih.gov/pmc/articles/PMC8307329/ https://ncbi.nlm.nih.gov/pubmed/34299598 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.3390/molecules26144323 |
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