Configuration Set

AFF_JCP_2022-alpha-glucose__CS_0khowajhl1dt_0



Name AFF_JCP_2022-alpha-glucose
Extended ID AFF_JCP_2022-alpha-glucose__CS_0khowajhl1dt_0
Description alpha-glucose configurations from AFF_JCP_2022 dataset
Elements C (25.0%)
H (50.0%)
O (25.0%)
Number of Configurations 3,000
Number of Atoms 72,000
Configurations
Datasets DS_5lhmgnxhuia3_0
ColabFit ID CS_0khowajhl1dt_0
Files colabfitspec.json

No uploaded content is transferred in ownership from the original creators to ColabFit. All content is distributed under the license specified by its contributor who has stated that he or she has the authority to share it under the specified license.