Published February 26, 2019
| Version v2
Dataset
Open
Interaction of N-3-oxododecanoyl homoserine lactone with transcriptional regulator LasR of Pseudomonas aeruginosa: Insights from molecular docking and dynamics simulations
Authors/Creators
- 1. Russian-Armenian University
Description
Dataset and supplementary files of the research: Interaction of N-3-oxododecanoyl homoserine lactone with transcriptional regulator LasR of Pseudomonas aeruginosa: Insights from molecular docking and dynamics simulations (https://doi.org/10.1101/121681)
- Supporting Information
- Input: Parameters and initial structures
- Output: Trajectories, Docking poses
Gromacs (multi-core with CUDA) was used for the simulations.
Autodock Vina, FlexAid and rDock were used for molecular docking.
Files
AdditionalFile1_SupportingInformation.pdf
Files
(4.1 GB)
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