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Hierarchical Graph Representation of Pharmacophore Models
For the investigation of protein-ligand interaction patterns, the current accessibility of a wide variety of sampling methods allows quick access to large-scale data. The main example is the intensive use of molecular dynamics simulations applied to crystallographic structures which provide dynamic...
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| Published in: | Front Mol Biosci |
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| Main Authors: | , , , , , , , , |
| Format: | Artigo |
| Language: | Inglês |
| Published: |
Frontiers Media S.A.
2020
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| Subjects: | |
| Online Access: | https://ncbi.nlm.nih.gov/pmc/articles/PMC7793842/ https://ncbi.nlm.nih.gov/pubmed/33425991 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.3389/fmolb.2020.599059 |
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