4bbcb5e8489388fa9b43ef1fc64751482ddf3fb3a1956dbb1865c8246679a61e  01_display/CMBG_9069_AMBER_RCSB_CCD_SNFG.pdb
3baaeb97afeb7c38c99864b4ee8ec539546719f6a2cdaa2acd1f95febfdb3fb2  01_display/CMBG_9069_AMBER_RCSB_CCD_all_atoms.mol2
e9c66d2c24dc8205f8f3fd28032833f928039140c36361ac705dc6fe68625b50  01_display/CMBG_9069_AMBER_RCSB_CCD_all_atoms.pdb
2573036394c3aa28c9ca8e69d165df35e532eb0f4df61baa3754b57f3e48b370  01_display/CMBG_9069_AMBER_RCSB_CCD_all_atoms.sdf
70fbef55d0eb9b850f019f34268a19a02f8100ad962ee1d4317cf5355caa4f7c  02_representative_structure/GLYCAM_TO_RCSB_CCD_MAPPING.tsv
4bbcb5e8489388fa9b43ef1fc64751482ddf3fb3a1956dbb1865c8246679a61e  02_representative_structure/representative_RCSB_CCD_SNFG.pdb
3baaeb97afeb7c38c99864b4ee8ec539546719f6a2cdaa2acd1f95febfdb3fb2  02_representative_structure/representative_RCSB_CCD_all_atoms.mol2
e9c66d2c24dc8205f8f3fd28032833f928039140c36361ac705dc6fe68625b50  02_representative_structure/representative_RCSB_CCD_all_atoms.pdb
2573036394c3aa28c9ca8e69d165df35e532eb0f4df61baa3754b57f3e48b370  02_representative_structure/representative_RCSB_CCD_all_atoms.sdf
a2fc0e21e5d26b3ff3aa607c40c94fcbd3f50f79808181c580c733d0fb373d8c  02_representative_structure/representative_native_GLYCAM.pdb
7a85c63b04dd96da55a641fc91b343e2b9f10af1382bd06bd98d448e07bc8806  02_representative_structure/structure.parm7
ab875b0f87dbbdcd99b4d39394ed4327f1bb65a08a2e0e93fc891fa215e71e28  03_exact_restart_after_30ns/prod_30ns.rst7
7a85c63b04dd96da55a641fc91b343e2b9f10af1382bd06bd98d448e07bc8806  03_exact_restart_after_30ns/structure.parm7
71e661708a71c840d9d2e025b0e4adae2e4ef7e67f10e8f89dea5099a9af4d09  04_conformers/alternate_medoids/cluster_02_medoid_native_GLYCAM.pdb
d902a6a2f3c897446daf3c642f0811ecd536d157f651dc4a2ade7bf39f3a2ef5  04_conformers/alternate_medoids/cluster_03_medoid_native_GLYCAM.pdb
ef2ed2361721794100a844a941518fa5f74d07976bf0d5f60c2082eee2748d3d  04_conformers/alternate_medoids/cluster_04_medoid_native_GLYCAM.pdb
a2fc0e21e5d26b3ff3aa607c40c94fcbd3f50f79808181c580c733d0fb373d8c  04_conformers/dominant_cluster_medoid_native_GLYCAM.pdb
ef184c1bceb61280a76fad8aab8f8d53932ca3b9c7e7b27ffd1a82918874b0a8  05_metadata/RCSB_CCD_DISPLAY_AUDIT.json
869ced54516bf47b3513959f08892e9fd21f34edb3b1f7d64c9d1ce033c77eae  05_metadata/cluster_summary.json
27a06aecde78aa585bf52af11f3a48d2cc799f9d50e6d604199d3dc7ee4c2b0c  05_metadata/cutoff_scan.tsv
05104baec1a3819c97c352fd991c21a8cdf78f5353b3323798c73acd2cfdf8b7  05_metadata/residue_mapping.tsv
f58f9020e5db98de8d6638e6d6298328ac9073727a480a47961d6e9e4341f467  05_metadata/workflow_config.json
7a85c63b04dd96da55a641fc91b343e2b9f10af1382bd06bd98d448e07bc8806  06_forcefield/structure.parm7
826d3ae0e8fbf9c9a8a136441a44512eb88c55e34f314195ed390a8193eda671  PACKAGE_STATUS.json
ec2140c0691e05a555f3e93ba446c1106b3236e637ed5bbf328b43e1b84c52ff  README_FIRST.txt
