cee6367eb4ddbd59386552f9947bc2c8745fb4a8464af973f7e1931905d0f4b6  01_display/CMBG_6650_GROMACS_RCSB_CCD_SNFG.pdb
44f430c4999dfac84f9f96264e0ff07f1aefd8584bb5e52af2f34488f3b02879  01_display/CMBG_6650_GROMACS_RCSB_CCD_all_atoms.mol2
caebbbf0f49387fb4c167c32ff25aa82239a4555b62c5a883c5fc34e145a703b  01_display/CMBG_6650_GROMACS_RCSB_CCD_all_atoms.pdb
c01fbb52e2e31e3baaea7d2fa3a672121d5dd57855dd14d365737de95069db14  01_display/CMBG_6650_GROMACS_RCSB_CCD_all_atoms.sdf
976505d252db825c3d1f9a2eb1a44370f40d62fac70cc033a569b1f1ec369980  02_representative_structure/GLYCAM_TO_RCSB_CCD_MAPPING.tsv
54eeb96c4854e24b5e82d0540246da0ca849a46ee08ad3630fc9e238b0c09c91  02_representative_structure/prod_006.tpr
cee6367eb4ddbd59386552f9947bc2c8745fb4a8464af973f7e1931905d0f4b6  02_representative_structure/representative_RCSB_CCD_SNFG.pdb
44f430c4999dfac84f9f96264e0ff07f1aefd8584bb5e52af2f34488f3b02879  02_representative_structure/representative_RCSB_CCD_all_atoms.mol2
caebbbf0f49387fb4c167c32ff25aa82239a4555b62c5a883c5fc34e145a703b  02_representative_structure/representative_RCSB_CCD_all_atoms.pdb
c01fbb52e2e31e3baaea7d2fa3a672121d5dd57855dd14d365737de95069db14  02_representative_structure/representative_RCSB_CCD_all_atoms.sdf
28ba04a9273385d59eda57e3dff60542946463f112253136bf044a00d269b965  02_representative_structure/representative_native_GLYCAM.pdb
40aa7daa22fe6fc4ed22559792b403581ce034778c442ece7f646deabca7ee4d  02_representative_structure/topol.top
54eeb96c4854e24b5e82d0540246da0ca849a46ee08ad3630fc9e238b0c09c91  03_exact_restart_after_30ns/prod_006.tpr
80775eabacd0d68c61f47ea029f5f553bf08853d5176bd5bb77d08a899c4cfa9  03_exact_restart_after_30ns/prod_30ns.gro
40aa7daa22fe6fc4ed22559792b403581ce034778c442ece7f646deabca7ee4d  03_exact_restart_after_30ns/topol.top
461fef580ff2360e2f84e96dbbf36ed036787793afee67b1bf6cc56976d83f87  04_conformers/alternate_medoids/cluster_02_medoid_native_GLYCAM.pdb
ba20fcc0065644c29419c808d80dde0bd59f885db40d7332486ace6989669935  04_conformers/alternate_medoids/cluster_03_medoid_native_GLYCAM.pdb
ae2591d67fe7d0f3466f7c8c79cc467ee8feb33cbe137bf0d104faa05549aba2  04_conformers/alternate_medoids/cluster_04_medoid_native_GLYCAM.pdb
28ba04a9273385d59eda57e3dff60542946463f112253136bf044a00d269b965  04_conformers/dominant_cluster_medoid_native_GLYCAM.pdb
64b7d46543fa37e72ccb24a5b31fb1260d757a88e94d23a1493c3c03517c7252  05_metadata/RCSB_CCD_DISPLAY_AUDIT.json
a5728daf3f9f51da112eca58e34655ad3efa0946ef82d1da62012526a2a5998c  05_metadata/cluster_summary.json
c43575365eb7b510d5043db0bf45332fba12ab89ec04c305bfa12ddc435138e5  05_metadata/cutoff_scan.tsv
8042aaf74d23d7909ef6a23744aca292bdd850a87c3f9a096718929f2c0b84df  05_metadata/residue_mapping.tsv
b359e50cc5cb7d5276b1c6f25a7a06d213d4874bde90278fa7e6b17d0fa2e6bc  05_metadata/workflow_config.json
54eeb96c4854e24b5e82d0540246da0ca849a46ee08ad3630fc9e238b0c09c91  06_forcefield/prod_006.tpr
40aa7daa22fe6fc4ed22559792b403581ce034778c442ece7f646deabca7ee4d  06_forcefield/topol.top
8c48ceea8f958d8de5046e2d9e8b1a0f30a0c385c12e79f87d5e1cb3ae17a0ad  PACKAGE_STATUS.json
9a25b31d2cff4a7a99c47de7337a92a22c49f0d700a54cd36919810274d5b578  README_FIRST.txt
