9959c94a7491a55670e45aeab185b4f55881ac2c10a767d073ec8e3c872988da  01_display/CMBG_10789_GROMACS_RCSB_CCD_SNFG.pdb
4e76aaddb57d17e30a12988c83c2ac829f39f43d54bd48207ec25c714a2662d4  01_display/CMBG_10789_GROMACS_RCSB_CCD_all_atoms.mol2
00e6fe8677d2b2d1ba660ed464ef0f910323d6f3de0df6b9caf183eefb06388a  01_display/CMBG_10789_GROMACS_RCSB_CCD_all_atoms.pdb
fea33da8f5d4346a81bc44c7464892753475506f5677d632631c5b70665dfb6e  01_display/CMBG_10789_GROMACS_RCSB_CCD_all_atoms.sdf
6adef87ed100185034b3b0731d48004bfeaab002229a40883647539f1da48f8a  02_representative_structure/GLYCAM_TO_RCSB_CCD_MAPPING.tsv
518a1c694b4fb9bf36a1eb87d6d7af0704924077a59f11015ddd84fc09a7b193  02_representative_structure/prod_006.tpr
9959c94a7491a55670e45aeab185b4f55881ac2c10a767d073ec8e3c872988da  02_representative_structure/representative_RCSB_CCD_SNFG.pdb
4e76aaddb57d17e30a12988c83c2ac829f39f43d54bd48207ec25c714a2662d4  02_representative_structure/representative_RCSB_CCD_all_atoms.mol2
00e6fe8677d2b2d1ba660ed464ef0f910323d6f3de0df6b9caf183eefb06388a  02_representative_structure/representative_RCSB_CCD_all_atoms.pdb
fea33da8f5d4346a81bc44c7464892753475506f5677d632631c5b70665dfb6e  02_representative_structure/representative_RCSB_CCD_all_atoms.sdf
4dd5b18c8ce927fe03b2c6652451f4465f72cbfcf433d7fb463d74947a40e0b3  02_representative_structure/representative_native_GLYCAM.pdb
d8e6655dfcb760c52c875877649eb710557c42248de65654274037e486125430  02_representative_structure/topol.top
518a1c694b4fb9bf36a1eb87d6d7af0704924077a59f11015ddd84fc09a7b193  03_exact_restart_after_30ns/prod_006.tpr
2fa5ac22ec30b8ea5c51177404fb890946711b026615e9241042f9f2bdf44fa9  03_exact_restart_after_30ns/prod_30ns.gro
d8e6655dfcb760c52c875877649eb710557c42248de65654274037e486125430  03_exact_restart_after_30ns/topol.top
614bc961a16a8b826752bd907c348bc4c24a2edfe0a445a8d52e24a6f4eba784  04_conformers/alternate_medoids/cluster_02_medoid_native_GLYCAM.pdb
f7d8750cf2f08872e049f3f1f5dadeac66e338a64865badfd1133f6731ca41e2  04_conformers/alternate_medoids/cluster_03_medoid_native_GLYCAM.pdb
fabf3f0080571851644e28289695e76c4022c425ff24cf06755a3ce5af11e412  04_conformers/alternate_medoids/cluster_04_medoid_native_GLYCAM.pdb
4dd5b18c8ce927fe03b2c6652451f4465f72cbfcf433d7fb463d74947a40e0b3  04_conformers/dominant_cluster_medoid_native_GLYCAM.pdb
51abd332fb5216bc1b78af11bceb7e73b80e6c9ebe6b9b4cd040d6e2a8b574c0  05_metadata/RCSB_CCD_DISPLAY_AUDIT.json
b952a72fd2e254dd21ffea79a1546fc96f8cf5e761410543dbc9225d62bc304b  05_metadata/cluster_summary.json
297a37943fb06852b6dcccd04f789a680fa7620c25ae38d48c2aea093e59f7c3  05_metadata/cutoff_scan.tsv
8042aaf74d23d7909ef6a23744aca292bdd850a87c3f9a096718929f2c0b84df  05_metadata/residue_mapping.tsv
3a9d8ffe1fe7bc87161ec88fb932e3f72a4e980e4f805fe0e1ba41c2520e2a8a  05_metadata/workflow_config.json
518a1c694b4fb9bf36a1eb87d6d7af0704924077a59f11015ddd84fc09a7b193  06_forcefield/prod_006.tpr
d8e6655dfcb760c52c875877649eb710557c42248de65654274037e486125430  06_forcefield/topol.top
bfe4211019e900e01bfd5a73b91e7fc4e3e76e19f1f95f26f865e31e6e399cad  PACKAGE_STATUS.json
a6447d1571c8eb1aac5c62f11539acfc9eb40359c7afbe52bd60f6f6a314adfd  README_FIRST.txt
