dc09472b643662d919848c3d945e0689299bdfa277e2951b57a5956d128848c7  01_display/CMBG_6003_GROMACS_RCSB_CCD_SNFG.pdb
29295103e12f4d52bba3017b6de36f401a77a192efdb6b73ac1714c2a38c84dc  01_display/CMBG_6003_GROMACS_RCSB_CCD_all_atoms.mol2
87f3f4cebb3d3d9c8bf9fa9cde2e175f05b34f4f3271d7baba174f086830695f  01_display/CMBG_6003_GROMACS_RCSB_CCD_all_atoms.pdb
8c1bf1a46fa9133d44ea18b714c69de3170d823d13aaf68fa90f6ff8e750b148  01_display/CMBG_6003_GROMACS_RCSB_CCD_all_atoms.sdf
722aafe4f803f8abee3cdcc49df457dc1d49ce0a5518bdf2c64495f25aa0bad1  02_representative_structure/GLYCAM_TO_RCSB_CCD_MAPPING.tsv
c97e50653d1e55da08a8b8e4fd531811e8dead01c6a4f8f094718280f504d9bb  02_representative_structure/prod_006.tpr
dc09472b643662d919848c3d945e0689299bdfa277e2951b57a5956d128848c7  02_representative_structure/representative_RCSB_CCD_SNFG.pdb
29295103e12f4d52bba3017b6de36f401a77a192efdb6b73ac1714c2a38c84dc  02_representative_structure/representative_RCSB_CCD_all_atoms.mol2
87f3f4cebb3d3d9c8bf9fa9cde2e175f05b34f4f3271d7baba174f086830695f  02_representative_structure/representative_RCSB_CCD_all_atoms.pdb
8c1bf1a46fa9133d44ea18b714c69de3170d823d13aaf68fa90f6ff8e750b148  02_representative_structure/representative_RCSB_CCD_all_atoms.sdf
db6811833654b3826f3ff5e0c9e7860b6794ab7acb2c40fc6688efc3fd3fcdd3  02_representative_structure/representative_native_GLYCAM.pdb
4a9515f976bd54bc3e7de033d00a1536a03d0b5f4afc3cab09576ca5866a973e  02_representative_structure/topol.top
c97e50653d1e55da08a8b8e4fd531811e8dead01c6a4f8f094718280f504d9bb  03_exact_restart_after_30ns/prod_006.tpr
e8b211d4f7d166d0746fd242eb1cee1cf578c56cc9576e0a0221e2e8673df5ab  03_exact_restart_after_30ns/prod_30ns.gro
3ffc743f679cd5c9101e2fc59e4461bf91840fcfb47b11617ef8c1337725cccb  03_exact_restart_after_30ns/state.cpt
4a9515f976bd54bc3e7de033d00a1536a03d0b5f4afc3cab09576ca5866a973e  03_exact_restart_after_30ns/topol.top
d9ef4706dcb8f1da105a7e9fa5bc9cdaf8a84d6a4ae67e7f94ec9ed64195b270  04_conformers/alternate_medoids/cluster_02_medoid_native_GLYCAM.pdb
313860b4c0c56cdc9e0a136b183bbf80604e3dec83aebc7b06b170ce8b6139f8  04_conformers/alternate_medoids/cluster_03_medoid_native_GLYCAM.pdb
43234acb7406626cfdc1d654ca9b0bfbd2f26c800fdc7642de7d4cead837da1b  04_conformers/alternate_medoids/cluster_04_medoid_native_GLYCAM.pdb
db6811833654b3826f3ff5e0c9e7860b6794ab7acb2c40fc6688efc3fd3fcdd3  04_conformers/dominant_cluster_medoid_native_GLYCAM.pdb
2b97f4c3c02edc098db310b44824a962b09ff264f7ca9edc66f949db43bc4cb6  05_metadata/RCSB_CCD_DISPLAY_AUDIT.json
f78567d4c89d824e0b954c5c2838142512aa913388861da997567c70169fbac2  05_metadata/cluster_summary.json
7eb849f29fe04022fa9df8a0f8b52532eeef404c2ca7d09c50d6eb72ba90b0be  05_metadata/cutoff_scan.tsv
984cfd905b3671102504c21e040a69dff384f967546806f66aeb7640739da6eb  05_metadata/residue_mapping.tsv
711498419153a2a599e00c38db6ad09953de27572d88dac145d13280aa8c94be  05_metadata/workflow_config.json
c97e50653d1e55da08a8b8e4fd531811e8dead01c6a4f8f094718280f504d9bb  06_forcefield/prod_006.tpr
4a9515f976bd54bc3e7de033d00a1536a03d0b5f4afc3cab09576ca5866a973e  06_forcefield/topol.top
bc60ce23480bc8358d0f3fa31f2af7c3c639906c500eba5c30e5aafb61affe58  PACKAGE_STATUS.json
03eca61f80c06c6dd80b35a5822ae09bfa101ee7aa8b46005b6ef8d8f28fa4c6  README_FIRST.txt
