APTAMD_EXAMPLE_2L5K
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https://data.mendeley.com/datasets/hg98523cbs
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资源简介:
This dataset contains all the input and output files that illustrate an example of the APTAMD protocol for the refinement of 3D structures of aptamer molecules. Note, however, that most of the big MD trajectory mdcrd files are not included. Only 10 out 20 mdcrd files containing the solute coordinates are kept in the 2L5K_MD/5.PRODUCTION folder. In case you wish to recalculate or access to all the trajectory files, please send e-mail to dimas@uniovi.es.



