Parmbsc1: a refined force field for DNA simulations
- Submitting institution
-
The University of Leeds
- Unit of assessment
- 9 - Physics
- Output identifier
- UOA9-1651
- Type
- D - Journal article
- DOI
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10.1038/NMETH.3658
- Title of journal
- Nature Methods
- Article number
- -
- First page
- 55
- Volume
- 13
- Issue
- 1
- ISSN
- 1548-7091
- Open access status
- Out of scope for open access requirements
- Month of publication
- November
- Year of publication
- 2015
- URL
-
-
- Supplementary information
-
-
- Request cross-referral to
- -
- Output has been delayed by COVID-19
- No
- COVID-19 affected output statement
- -
- Forensic science
- No
- Criminology
- No
- Interdisciplinary
- No
- Number of additional authors
-
18
- Research group(s)
-
E - Theoretical Physics
- Citation count
- 310
- Proposed double-weighted
- No
- Reserve for an output with double weighting
- No
- Additional information
- -
- Author contribution statement
- The latest molecular dynamics (MD) force-field (parmBSC1) for atomistic modelling of nucleic acids, corrects known artefacts in the previous incarnation (parmBSC0). Simulations of DNA minicircles, which were performed by Noy (PDRA) and Harris, were chosen as an exemplar system for validation of the new parameter set as Harris has established minicircles as essential test systems for assessing the performance of new DNA force-fields.
- Non-English
- No
- English abstract
- -
