7c90e1698cd0318a2df7bd64f8d36fa5e6f0a6003bbd7e3fb500df196931abe3  01_display/CMBG_11316_GROMACS_RCSB_CCD_SNFG.pdb
7617c81675bd4a36a8932fb7890b2e3496123ba174044530ff417b1d3353b968  01_display/CMBG_11316_GROMACS_RCSB_CCD_all_atoms.mol2
986fee2ac13027400f39b0b7a1f7312fbecaac37793f06b41f7bdbe1e64a714e  01_display/CMBG_11316_GROMACS_RCSB_CCD_all_atoms.pdb
d08cf109ea57fe7dad60ed9aa426d7ae27fae2512205f0238158f6cd17e08489  01_display/CMBG_11316_GROMACS_RCSB_CCD_all_atoms.sdf
9d9b2d10b1ffabb2fc1b694c05a6f173d5209ee6f68420a6e644ce57351548e2  02_representative_structure/GLYCAM_TO_RCSB_CCD_MAPPING.tsv
ee672f6c1ca037ba3eadbba345b452289d98e98789aecc4e98c7c0a161de37b6  02_representative_structure/prod_006.tpr
7c90e1698cd0318a2df7bd64f8d36fa5e6f0a6003bbd7e3fb500df196931abe3  02_representative_structure/representative_RCSB_CCD_SNFG.pdb
7617c81675bd4a36a8932fb7890b2e3496123ba174044530ff417b1d3353b968  02_representative_structure/representative_RCSB_CCD_all_atoms.mol2
986fee2ac13027400f39b0b7a1f7312fbecaac37793f06b41f7bdbe1e64a714e  02_representative_structure/representative_RCSB_CCD_all_atoms.pdb
d08cf109ea57fe7dad60ed9aa426d7ae27fae2512205f0238158f6cd17e08489  02_representative_structure/representative_RCSB_CCD_all_atoms.sdf
dfae15de9bbccbc745a660691cc02af2d7f76edfe2d645ea5e6a9c0cd916174b  02_representative_structure/representative_native_GLYCAM.pdb
82c0d8ea6f704acb39e75e12dca59b79d035aed078e8c2a8056c73af36f2325b  02_representative_structure/topol.top
ee672f6c1ca037ba3eadbba345b452289d98e98789aecc4e98c7c0a161de37b6  03_exact_restart_after_30ns/prod_006.tpr
d3bf183bd41f3e843e831d4e485f1c22007f7152096d4634a53e311b7da71259  03_exact_restart_after_30ns/prod_30ns.gro
82c0d8ea6f704acb39e75e12dca59b79d035aed078e8c2a8056c73af36f2325b  03_exact_restart_after_30ns/topol.top
5581f97201069aaab54d3274c5d247cd8720563530a67432cacd682f601e72b3  04_conformers/alternate_medoids/cluster_02_medoid_native_GLYCAM.pdb
fc5ffb91d45eace49bcdbf9e2a624e3d7fd48086ae7c994553a4710fd08a7fc3  04_conformers/alternate_medoids/cluster_03_medoid_native_GLYCAM.pdb
5e59f55ce34b1b188d529327d379f7df6b707e1b4539eaa88b3903c24214a8b0  04_conformers/alternate_medoids/cluster_04_medoid_native_GLYCAM.pdb
dfae15de9bbccbc745a660691cc02af2d7f76edfe2d645ea5e6a9c0cd916174b  04_conformers/dominant_cluster_medoid_native_GLYCAM.pdb
a3be355f75ac876e5e5d596d7db3f514a40a340bab79a98019dc147a9a333a61  05_metadata/RCSB_CCD_DISPLAY_AUDIT.json
c0de8913283b54a9e4f4b2f53a71ab75e4e4f9fa97e0a217b7a6862910361815  05_metadata/cluster_summary.json
4d37a19d5d804f351e2b50601c63e31fe7cde7c64dbd87ea517b54697cd5b8e5  05_metadata/cutoff_scan.tsv
5829ef73f6e7f956b5be70ac6174cb17a04d17f48e32171dd4171714bcfb5dd3  05_metadata/residue_mapping.tsv
3906bef7a69fdbfe291fa08a69436e073dc7e64bf3ddf2fdf2ff8b2a85043afa  05_metadata/workflow_config.json
ee672f6c1ca037ba3eadbba345b452289d98e98789aecc4e98c7c0a161de37b6  06_forcefield/prod_006.tpr
82c0d8ea6f704acb39e75e12dca59b79d035aed078e8c2a8056c73af36f2325b  06_forcefield/topol.top
09ed6f760c3d8137ff049ab731f3fb64ba23f62c4b7aeb4df42f8aaa6b10cb33  PACKAGE_STATUS.json
d6300e18ec5f987aea3516b413c2ebc74642d2a960e85556544ee3a15164bcd8  README_FIRST.txt
