bee097538c451311531065af3a2192732b22fe2f46e8f79f92e32fc8e8b4b9c7  01_display/CMBG_22826_GROMACS_RCSB_CCD_SNFG.pdb
f62d3f264e6501489a3eb0c60d1062cdb401c548c4e6e1ea7a632b03b9a0444c  01_display/CMBG_22826_GROMACS_RCSB_CCD_all_atoms.mol2
a6a0f7701f403a78b313655d17c7cec0a7053ac8e6bd08dcd0d486065be3b88f  01_display/CMBG_22826_GROMACS_RCSB_CCD_all_atoms.pdb
52a227c481625cedba66a59da06ec632f8943346637138fb6bf2cd07064a04e4  01_display/CMBG_22826_GROMACS_RCSB_CCD_all_atoms.sdf
c7bcc4a76418855e892b0bbfad1eae4aabbed081dbfd0cc0f58da9e42e79fce1  02_representative_structure/GLYCAM_TO_RCSB_CCD_MAPPING.tsv
33d0f490c416d647a69c811208fdd80725ec04e57ad7ec09177e6602f06b613e  02_representative_structure/prod_006.tpr
bee097538c451311531065af3a2192732b22fe2f46e8f79f92e32fc8e8b4b9c7  02_representative_structure/representative_RCSB_CCD_SNFG.pdb
f62d3f264e6501489a3eb0c60d1062cdb401c548c4e6e1ea7a632b03b9a0444c  02_representative_structure/representative_RCSB_CCD_all_atoms.mol2
a6a0f7701f403a78b313655d17c7cec0a7053ac8e6bd08dcd0d486065be3b88f  02_representative_structure/representative_RCSB_CCD_all_atoms.pdb
52a227c481625cedba66a59da06ec632f8943346637138fb6bf2cd07064a04e4  02_representative_structure/representative_RCSB_CCD_all_atoms.sdf
5aff28a04afecc442e8b9f15c7761d2d1b62dfb2270152798bafb5c0bfee484f  02_representative_structure/representative_native_GLYCAM.pdb
d221b1761cb83e6e2c9528b1ac282ce32eda2573d672321f4abde8b7411ef401  02_representative_structure/topol.top
33d0f490c416d647a69c811208fdd80725ec04e57ad7ec09177e6602f06b613e  03_exact_restart_after_30ns/prod_006.tpr
9686ffd443d309577ae7cedccd584d284e15457ac61d5c38fe2fee53a6959074  03_exact_restart_after_30ns/prod_30ns.gro
d221b1761cb83e6e2c9528b1ac282ce32eda2573d672321f4abde8b7411ef401  03_exact_restart_after_30ns/topol.top
71333efcd425e2e47c627368dd27fc5aaa8b2227765a628ae8ac4dc2bbcbd3aa  04_conformers/alternate_medoids/cluster_02_medoid_native_GLYCAM.pdb
30505e84fe7099337dd0a163e041baba6c14ada16b3dd727c0cdde8e8f724b28  04_conformers/alternate_medoids/cluster_03_medoid_native_GLYCAM.pdb
4ad07741b081f9d2c14e40a168930df7dd300a99cb566e6f386a582a65308ab6  04_conformers/alternate_medoids/cluster_04_medoid_native_GLYCAM.pdb
5aff28a04afecc442e8b9f15c7761d2d1b62dfb2270152798bafb5c0bfee484f  04_conformers/dominant_cluster_medoid_native_GLYCAM.pdb
f7af54b80cced1d9f0b5afa962d5db9c9c4feb889329a3e6c813a4a0ec92a003  05_metadata/RCSB_CCD_DISPLAY_AUDIT.json
e4243bd5b75f25bbb3918d7bd2753b8581928b2fb2eb7475ac97fff0f3c47889  05_metadata/cluster_summary.json
cbfa877bdccfe2596e960cbddd78817df16fdcb2d060e13b9530d45df13aa29d  05_metadata/cutoff_scan.tsv
8042aaf74d23d7909ef6a23744aca292bdd850a87c3f9a096718929f2c0b84df  05_metadata/residue_mapping.tsv
a6ef92256b31eec878ffbe9ca64e1091ce83858b17ef7742f16deaaef88e6f91  05_metadata/workflow_config.json
33d0f490c416d647a69c811208fdd80725ec04e57ad7ec09177e6602f06b613e  06_forcefield/prod_006.tpr
d221b1761cb83e6e2c9528b1ac282ce32eda2573d672321f4abde8b7411ef401  06_forcefield/topol.top
029335bccc1bc75e4f9e381d240c1f569596ae6041864a22606181104be3606c  PACKAGE_STATUS.json
823547e75365144e5dd831fdb41897b24738f958610da7eaad194ced8d2ddcf7  README_FIRST.txt
