Improvement of the Force Field for <i>β</i>-<span style="font-variant: small-caps">d</span>-Glucose with Machine Learning
While the construction of a dependable force field for performing classical molecular dynamics (MD) simulation is crucial for elucidating the structure and function of biomolecular systems, the attempts to do this for glycans are relatively sparse compared to those for proteins and nucleic acids. Cu...
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| Main Authors: | , , , |
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| Format: | article |
| Language: | EN |
| Published: |
MDPI AG
2021
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| Subjects: | |
| Online Access: | https://doaj.org/article/c40d61b4b8744672a6bd528b30abbf99 |
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