eb028ebbe42d63a550500cd781edaca172e94528fa24a45f633a471922ec8166  01_display/CMBG_6026_GROMACS_RCSB_CCD_SNFG.pdb
a0fa64a989960b0e19980ab47dd8551f47f6243d7d21c9ccdaae35dc6b143e5d  01_display/CMBG_6026_GROMACS_RCSB_CCD_all_atoms.mol2
ce93ba76071b0699660693be8b13c2c78ef35aeb1f255e174cd7f62d730857ed  01_display/CMBG_6026_GROMACS_RCSB_CCD_all_atoms.pdb
9e6b48a00ab01bccf4c79465e3541c3d3340e242959dc14c5e6544df6c4a2bcd  01_display/CMBG_6026_GROMACS_RCSB_CCD_all_atoms.sdf
2235472e1fae1df7a6fac99a5c383665e186fe6116d9bb23ba4c6b60d1632b88  02_representative_structure/GLYCAM_TO_RCSB_CCD_MAPPING.tsv
e09f89ef92943e01f3ee400582b416f854cca57dbdf3e156b423bc09b2b9bf16  02_representative_structure/prod_006.tpr
eb028ebbe42d63a550500cd781edaca172e94528fa24a45f633a471922ec8166  02_representative_structure/representative_RCSB_CCD_SNFG.pdb
a0fa64a989960b0e19980ab47dd8551f47f6243d7d21c9ccdaae35dc6b143e5d  02_representative_structure/representative_RCSB_CCD_all_atoms.mol2
ce93ba76071b0699660693be8b13c2c78ef35aeb1f255e174cd7f62d730857ed  02_representative_structure/representative_RCSB_CCD_all_atoms.pdb
9e6b48a00ab01bccf4c79465e3541c3d3340e242959dc14c5e6544df6c4a2bcd  02_representative_structure/representative_RCSB_CCD_all_atoms.sdf
ee69176be0b5fdb5b8fceb2c395e67be221ace3ea9c484bef9e742cfc63b9ee5  02_representative_structure/representative_native_GLYCAM.pdb
65a10df119637a3fdf2efedd04094382fd3ff35a5cd89763eaac8bff9e2f5289  02_representative_structure/topol.top
e09f89ef92943e01f3ee400582b416f854cca57dbdf3e156b423bc09b2b9bf16  03_exact_restart_after_30ns/prod_006.tpr
727efea6e2606133fe37bdbc825ac72b337ee46d21c0bc5453736877de431f5f  03_exact_restart_after_30ns/prod_30ns.gro
65a10df119637a3fdf2efedd04094382fd3ff35a5cd89763eaac8bff9e2f5289  03_exact_restart_after_30ns/topol.top
1e4c9caf6c38359d9ca3a292035eb3029cc934a04d9ce70123c8d6f5a1ac0d79  04_conformers/alternate_medoids/cluster_02_medoid_native_GLYCAM.pdb
bc8e463a42059ee74f3648a94cf6bca686eeae1e98eb6d42198a051c1b20d8ee  04_conformers/alternate_medoids/cluster_03_medoid_native_GLYCAM.pdb
79dac16a392306f4d8e72278056965f15af843b3a7ed20a027cb92b6f54dd870  04_conformers/alternate_medoids/cluster_04_medoid_native_GLYCAM.pdb
ee69176be0b5fdb5b8fceb2c395e67be221ace3ea9c484bef9e742cfc63b9ee5  04_conformers/dominant_cluster_medoid_native_GLYCAM.pdb
b25563570d99b0fc8d04ebe787928d4eb77ca9650ccddebea69b337c534d205a  05_metadata/RCSB_CCD_DISPLAY_AUDIT.json
053a64b1f56214bf996cb748b8840a9a4fa43d4e1e994cf8d86b835cadaea04a  05_metadata/cluster_summary.json
eafa9a9a85e7f60750c8d509bb49084fb0813e5dbd52c16a90b47ead363bfcc3  05_metadata/cutoff_scan.tsv
8042aaf74d23d7909ef6a23744aca292bdd850a87c3f9a096718929f2c0b84df  05_metadata/residue_mapping.tsv
ca79a9f654449e643cbec640f1beb78e765ded8ba8d3d6ca45159ed7d2f68b8c  05_metadata/workflow_config.json
e09f89ef92943e01f3ee400582b416f854cca57dbdf3e156b423bc09b2b9bf16  06_forcefield/prod_006.tpr
65a10df119637a3fdf2efedd04094382fd3ff35a5cd89763eaac8bff9e2f5289  06_forcefield/topol.top
5b90d4a5f0a6b13d14e28684dccf796cc01c9886a3c784474bb1d88920b6afbd  PACKAGE_STATUS.json
d59487b4043ab74946fa052bee1dc1fa8d4c3108a72136a887c8db3634a0af4d  README_FIRST.txt
