Configuration Set

paracetamol__CS_f9uzr69v4nr0_0




Name paracetamol
Extended ID paracetamol__CS_f9uzr69v4nr0_0
Description Paracetamol rmd17 configurations
Elements C (40.0%)
H (45.0%)
N (5.0%)
O (10.0%)
Number of Configurations 100,000
Number of Atoms 2,000,000
Configurations
Datasets DS_8rafgy0ly6bt_0
ColabFit ID CS_f9uzr69v4nr0_0
Files colabfitspec.json

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