f5a37f60a4673342f626dd00ee1bf05191aec51722e7b509d96129869d4df6c5  01_display/CMBG_5081_representative.mol2
ebd695cbc4c9332f553d7756cb8615ef28e4116ecdada3f90bcf49618f0f7dc9  01_display/CMBG_5081_representative.sdf
478634f26dcee70a42b5161a793aaa34769b24c65ee9cda6f106a769284e1e9d  01_display/CMBG_5081_representative_visual.pdb
76b5414c7350e96da03525c417d9a8af7ecc3aa8f2bb2a01093326c407c39439  02_representative_structure/CMBG_5081_representative_fullsystem.coor
0091caf62a4e347535dd3322f4f100ecec3eb79d4d4121927e40a305d62d0074  02_representative_structure/CMBG_5081_representative_fullsystem.psf
976e01c148903199145df5462acb6d85e4e85b1c5e69676b7a46b4ccf6155f42  02_representative_structure/CMBG_5081_representative_fullsystem_visual.pdb
6730b9847d5696be52aeac72902e7d5a504be1ba340bed60472c92d0e4f6e712  02_representative_structure/CMBG_5081_representative_glycan.coor
528d579a3890b34eed76f5f93bded6aa6ca8099d096052d19e33974f9acb9f03  02_representative_structure/CMBG_5081_representative_glycan.psf
478634f26dcee70a42b5161a793aaa34769b24c65ee9cda6f106a769284e1e9d  02_representative_structure/CMBG_5081_representative_visual.pdb
0091caf62a4e347535dd3322f4f100ecec3eb79d4d4121927e40a305d62d0074  03_exact_restart_after_30ns/CMBG_5081_ionized.psf
02a4ba8580da54711febe85262d84523cfe908947a7763295c4e340ffb0cff43  03_exact_restart_after_30ns/CMBG_5081_prod_s03.restart.coor
97293198a561cc45b844ff3c075b4daf7a6600d47c99e12dd4ce4db2ef5925c6  03_exact_restart_after_30ns/CMBG_5081_prod_s03.restart.vel
6283af16d2490b5677c750bf2af7d281967b411873da2a9f811547f507d7e84a  03_exact_restart_after_30ns/CMBG_5081_prod_s03.restart.xsc
30a6cfd2b9819ef603578ef18a2cd480aff2c8d38c083fd47ac508e65756c4d8  04_conformers/CMBG_5081_cluster02_medoid_glycan.coor
0e4149d6d394e0fe290c568edc82b6af04d53cbbfa084f3da62a6a8dadd24f86  04_conformers/CMBG_5081_cluster02_medoid_visual.pdb
b63cd56fff74583f986d9101c0e156817463cc242371882bde0b2c5f23b61e69  04_conformers/CMBG_5081_cluster03_medoid_glycan.coor
fea871b944fa98d1ee09e9e9f80577ae831e3bbf26e06578dfe1bf30679c50f1  04_conformers/CMBG_5081_cluster03_medoid_visual.pdb
cba6171d92c0fd4955d4eb153f3df1e7a18a961eedf37e9eacbbc819e42496a9  05_metadata/README_REUSE.txt
b069b849a314e92c6be08db391da61a12ee9d7716fc7bded0a88bb5ddba911d4  05_metadata/alternate_medoids.tsv
31528e2f57b6dd1f04b5ed2d64f05c4aed54c88cb5069b2456612ec46c96b081  05_metadata/alternate_selection_status.tsv
eb0976adf0abfd9a227bd13a3f018a6366587ba87505ac7f765f390ff7ce0a5c  05_metadata/alternate_validation_status.tsv
d36743d3ae5edb051609514ad2b1d4dbd8dabba07494b1178e1cd681d708efb9  05_metadata/cluster_summary.tsv
5c02b890b6cfaefc8f61a7dc5019f860c76d6ad193867730a5f9090d6a601d89  05_metadata/cutoff_scan.tsv
d02aa343d8a69ca9fc2a59693dca35c56cfd62b2114dcbc92a440a382f27f7ac  05_metadata/package_provenance.json
5e9bef76a4163f6cbc760d7282351c0333f153f81024a3cffa3122120bd4d95f  05_metadata/representative_metadata.json
531fbcb26e36690f7b4a1cb13c479c972d6b2243e54705e98b84b5f836ddc1ef  05_metadata/representative_metadata.tsv
389536c0e23d3b897918ce9e900f3029194592ecef129eb8fe79930c1e03ac54  05_metadata/representative_validation.txt
249cd20b93dc3379575c039c9ce24bae1dfc3f2690bd801016f48da370f08a5b  05_metadata/sampling_validation.txt
896d4e3b16f3a97998c0b64684822cdc47576067cd34393572080a6e1b899deb  05_metadata/selected_frame.txt
a4e4decc6861174bcb32c1b6c27ed19b84e22c66e59560949ae8d7a15c9bc9bb  05_metadata/status.tsv
9acd5f1d887afaf5e2cdc0e420440ab912cc2b584f787120d6845dd077d58ee6  06_forcefield/par_all36_carb.prm
2fbf1da5665b24265c6fb749765cab9d82152e3588b4d971a2ab9adba12857ed  06_forcefield/toppar_water_ions_feb2026_namd.prm
72eb8f21ca44d14d456c6355604668ab945c2c20827d5e8f33fa25a39c1326a4  FILE_MANIFEST.tsv
7ecb241e3d751e306ca2500344d264f08dc70908e5412d4bd429e74784c0b824  PACKAGE_STATUS.json
066314bf254c6886c513736e1095af1dba968f5f84bf90f47cf7544210efbdc7  README_FIRST.txt
