Final raw data Docking and Molecular dynamics

Published: 22 February 2021| Version 1 | DOI: 10.17632/tvksvtdbs7.1
Aura Caterine Castillo


These data correspond to the results of molecular docking tests between the E envelope protein of the dengue virus and the GLUN2A subunit of the NMDA receptor and also contain the results of molecular dynamics between the two proteins evaluated.


Steps to reproduce

Download the first file. rar from the molecular dynamics named archives and extract to a folder, which will allow you to get a complete 12 megabyte excel file. To view the docking data in pdb format, you must open them in the pymol program and the protein-protein docking haddocks can be viewed as a text file.


Universidad Nacional de Colombia


Computational Inorganic Chemistry