Configuration Set

ANI-2x-wB97X-631Gd_num_atoms_3__CS_2zr8phomd43e_0



Name ANI-2x-wB97X-631Gd_num_atoms_3
Extended ID ANI-2x-wB97X-631Gd_num_atoms_3__CS_2zr8phomd43e_0
Description Configurations with 3 atoms from ANI-2x-wB97X-631Gd dataset
Elements C (6.97%)
H (34.83%)
N (12.01%)
O (39.12%)
S (7.06%)
Number of Configurations 3,643
Number of Atoms 10,929
Configurations
Datasets DS_rde4chkdmm18_0
ColabFit ID CS_2zr8phomd43e_0
Files colabfitspec.json

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