882b7014f30a58e5611d07fe53306c5144aeec589880ddbf9f126bcf52486f2f  01_display/CMBG_3612_GROMACS_RCSB_CCD_SNFG.pdb
8f5910df97c53ce84bae02d3607b8fa4afaa53c0a21e9c533cd70d1d968ed751  01_display/CMBG_3612_GROMACS_RCSB_CCD_all_atoms.mol2
a0da31736c41cefceb2f4fea5ba75b94fd88f2b3b132ef9403fd5e9b859fd5cf  01_display/CMBG_3612_GROMACS_RCSB_CCD_all_atoms.pdb
22911e5d108e42351f0fdfaf0712b2be7637e956a6615e9a455520c0be583536  01_display/CMBG_3612_GROMACS_RCSB_CCD_all_atoms.sdf
0e4a6b303744f921a939e64385aab3230ed8639518bbccda54e9d639359a5cfd  02_representative_structure/GLYCAM_TO_RCSB_CCD_MAPPING.tsv
41a28545a0f69ad463f30e5c7ab2135394f75a83e1e554e7d81afe6c1273d3e4  02_representative_structure/prod_006.tpr
882b7014f30a58e5611d07fe53306c5144aeec589880ddbf9f126bcf52486f2f  02_representative_structure/representative_RCSB_CCD_SNFG.pdb
8f5910df97c53ce84bae02d3607b8fa4afaa53c0a21e9c533cd70d1d968ed751  02_representative_structure/representative_RCSB_CCD_all_atoms.mol2
a0da31736c41cefceb2f4fea5ba75b94fd88f2b3b132ef9403fd5e9b859fd5cf  02_representative_structure/representative_RCSB_CCD_all_atoms.pdb
22911e5d108e42351f0fdfaf0712b2be7637e956a6615e9a455520c0be583536  02_representative_structure/representative_RCSB_CCD_all_atoms.sdf
3b231bbd967bbf478fcfe2f4e6af3a7f7f63794304a7fe96cf9d3a4f7e199d4b  02_representative_structure/representative_native_GLYCAM.pdb
dc67c55a3ba3a48857308d5039c4620f906ae314d109c511523fe14e77abe5ec  02_representative_structure/topol.top
41a28545a0f69ad463f30e5c7ab2135394f75a83e1e554e7d81afe6c1273d3e4  03_exact_restart_after_30ns/prod_006.tpr
bc0864ebfc50c3c620dfcf5ff74b2b087251439e295a24ffdf1968350e53c654  03_exact_restart_after_30ns/prod_30ns.gro
dc67c55a3ba3a48857308d5039c4620f906ae314d109c511523fe14e77abe5ec  03_exact_restart_after_30ns/topol.top
691011557b082485e902171b595bfc392bfbb7e89d03c004e0a411f34a82628f  04_conformers/alternate_medoids/cluster_02_medoid_native_GLYCAM.pdb
25126a0bbbb3487aefd4d9695604d0f52779288696397e36cb5fe936b179ad77  04_conformers/alternate_medoids/cluster_03_medoid_native_GLYCAM.pdb
8b5fff039f88cd6144ea2b62ab7d54832d1d27ab4ee81f4d0456637f9f00cdec  04_conformers/alternate_medoids/cluster_04_medoid_native_GLYCAM.pdb
3b231bbd967bbf478fcfe2f4e6af3a7f7f63794304a7fe96cf9d3a4f7e199d4b  04_conformers/dominant_cluster_medoid_native_GLYCAM.pdb
12c61bdd81c070460c62533cbd46f7c6bdbbec7a6cf827d637914c92cc555c57  05_metadata/RCSB_CCD_DISPLAY_AUDIT.json
64e792db10f908597396664b0e80ab04de4f2030ce5637e4c26cb29c7be57325  05_metadata/cluster_summary.json
f4f5e7784855fddc91829f6aa63d064f2bfcd7972f54896a5909f64d76887ce2  05_metadata/cutoff_scan.tsv
8042aaf74d23d7909ef6a23744aca292bdd850a87c3f9a096718929f2c0b84df  05_metadata/residue_mapping.tsv
757261b6cd0959f1ba225a8a53247849cb82c3ebd99eccfa615eced5d28b77b3  05_metadata/workflow_config.json
41a28545a0f69ad463f30e5c7ab2135394f75a83e1e554e7d81afe6c1273d3e4  06_forcefield/prod_006.tpr
dc67c55a3ba3a48857308d5039c4620f906ae314d109c511523fe14e77abe5ec  06_forcefield/topol.top
944b93de0470ee326e292fe18e37c008e4787eda384c1f0a2f321463500db58c  PACKAGE_STATUS.json
7838b2df2a3b33a7e2655b49a25ca502ca028ce52eb4ff67bad64290592e644e  README_FIRST.txt
