02a7f7b0e0359087e10fe842246dfe5a660e36f0191378f61696fe8ae6a0f343  01_display/CMBG_21081_GROMACS_RCSB_CCD_SNFG.pdb
4b808089097a1614b9b70da5ce2809d3038ca277893ead307015fee59dad2afd  01_display/CMBG_21081_GROMACS_RCSB_CCD_all_atoms.mol2
fdf44c3cbbb316e9d68aa7b88b1476dd86510e936a5eed79c90ad64fdd68eb25  01_display/CMBG_21081_GROMACS_RCSB_CCD_all_atoms.pdb
30e12337c184b71f80464794ea0c437b10ce1fd750d172e7ed351f8a94bfb095  01_display/CMBG_21081_GROMACS_RCSB_CCD_all_atoms.sdf
9491b6e2045a475c1992a01a8eaf77629969dfb815ffdcf71f53e9b5cf35b9a3  02_representative_structure/GLYCAM_TO_RCSB_CCD_MAPPING.tsv
7fe36f82ae9a58531edfa9bde7aa99f5b4fffc7ae519a05b1d9655d8212d2346  02_representative_structure/prod_006.tpr
02a7f7b0e0359087e10fe842246dfe5a660e36f0191378f61696fe8ae6a0f343  02_representative_structure/representative_RCSB_CCD_SNFG.pdb
4b808089097a1614b9b70da5ce2809d3038ca277893ead307015fee59dad2afd  02_representative_structure/representative_RCSB_CCD_all_atoms.mol2
fdf44c3cbbb316e9d68aa7b88b1476dd86510e936a5eed79c90ad64fdd68eb25  02_representative_structure/representative_RCSB_CCD_all_atoms.pdb
30e12337c184b71f80464794ea0c437b10ce1fd750d172e7ed351f8a94bfb095  02_representative_structure/representative_RCSB_CCD_all_atoms.sdf
3f370bfff21532ecaf90a7aa6d3e55898aacbfb2422680f256bdce6a2b5d717b  02_representative_structure/representative_native_GLYCAM.pdb
cfe4beadd85dd2c5256c4945d9f49b4d69f412ae941ab1849952aab50efd7c68  02_representative_structure/topol.top
7fe36f82ae9a58531edfa9bde7aa99f5b4fffc7ae519a05b1d9655d8212d2346  03_exact_restart_after_30ns/prod_006.tpr
4f9be04acad1d05cced40932aaca07fe8351eaa0785ccacc8b04a8b2ecb24339  03_exact_restart_after_30ns/prod_30ns.gro
d8e6725a3d4c372f13def058c29366aa5dcc5c55a3d910f07b7bee43f33a3919  03_exact_restart_after_30ns/state.cpt
cfe4beadd85dd2c5256c4945d9f49b4d69f412ae941ab1849952aab50efd7c68  03_exact_restart_after_30ns/topol.top
1f913b7e6c07957652144361ea22eaa8a19acdd51916ceb1005658d543a5c731  04_conformers/alternate_medoids/cluster_02_medoid_native_GLYCAM.pdb
b2974a65574458ffa90f5263f5d446cba538189c3326e38c4acb0a26aecf5d30  04_conformers/alternate_medoids/cluster_03_medoid_native_GLYCAM.pdb
0c4244ff40d5ebb59e162021512c3986d68fea33689fb0ebc61927416bc11f7e  04_conformers/alternate_medoids/cluster_04_medoid_native_GLYCAM.pdb
3f370bfff21532ecaf90a7aa6d3e55898aacbfb2422680f256bdce6a2b5d717b  04_conformers/dominant_cluster_medoid_native_GLYCAM.pdb
4618da76ef99971790dde0fb9e78aaa3c928add9fab086bdac011ba91f268602  05_metadata/RCSB_CCD_DISPLAY_AUDIT.json
88b9f5ea656eb39ab777224d26ac01a0df1b7f2c73c552af6d30c2b8f07d6758  05_metadata/cluster_summary.json
d8c3f158d839ef6200faf499f7219f20deee73ee402b8f0d76ad00fd118b741d  05_metadata/cutoff_scan.tsv
3c760a53acc173f6fd34c83fcc4401b8d71a5abf84b768f57178871e9719b901  05_metadata/residue_mapping.tsv
e8c109a1004ce9a2ccd05b43e5a9a29da321dd394e46541ad750aaaf0fd65db9  05_metadata/workflow_config.json
7fe36f82ae9a58531edfa9bde7aa99f5b4fffc7ae519a05b1d9655d8212d2346  06_forcefield/prod_006.tpr
cfe4beadd85dd2c5256c4945d9f49b4d69f412ae941ab1849952aab50efd7c68  06_forcefield/topol.top
dff65c32e31a4a377401ae88213c6b4f9a4c55a09dd43ec4b11ce97413f5aef5  PACKAGE_STATUS.json
d348db94886daa20084c3afab19c6d6590899c3ae58976000a910630b1b60feb  README_FIRST.txt
