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From Data to Knowledge: Systematic Review of Tools for Automatic Analysis of Molecular Dynamics Output
An increasing number of crystal structures available on one side, and the boost of computational power available for computer-aided drug design tasks on the other, have caused that the structure-based drug design tools are intensively used in the drug development pipelines. Docking and molecular dyn...
| Autores principales: | , |
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| Formato: | Online Artículo Texto |
| Lenguaje: | English |
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Frontiers Media S.A.
2022
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| Materias: | |
| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8960308/ https://www.ncbi.nlm.nih.gov/pubmed/35359865 http://dx.doi.org/10.3389/fphar.2022.844293 |