Hugging Face
Models
Datasets
Spaces
Buckets
new
Docs
Enterprise
Pricing
Log In
Sign Up
Datasets:
InstaDeepAI
/
MLIPAudit-data
like
0
Follow
InstaDeep Ltd
403
Languages:
English
Dataset card
Files
Files and versions
xet
Community
15
refs/pr/8
MLIPAudit-data
22.6 MB
3 contributors
History:
33 commits
leonwehrhan
Upload 2 files
899a982
6 months ago
.gitattributes
Safe
2.46 kB
initial commit
8 months ago
README.md
Safe
360 Bytes
Create README.md (#3)
8 months ago
bond_length_distribution.zip
pickle
Pickle imports
No problematic imports detected
What is a pickle import?
2.17 kB
xet
Upload 2 files
6 months ago
conformer_selection.zip
Safe
pickle
Pickle imports
No problematic imports detected
What is a pickle import?
73.9 kB
xet
Upload conformer_selection.zip
8 months ago
dihedral_scan.zip
Safe
pickle
Pickle imports
No problematic imports detected
What is a pickle import?
3.09 MB
xet
Upload dihedral_scan.zip
8 months ago
folding_stability.zip
Safe
pickle
Pickle imports
No problematic imports detected
What is a pickle import?
275 kB
xet
Upload folding_stability.zip
8 months ago
noncovalent_interactions.zip
Safe
pickle
Pickle imports
No problematic imports detected
What is a pickle import?
3.01 MB
xet
Upload noncovalent_interactions.zip
6 months ago
reactivity.zip
Safe
pickle
Pickle imports
No problematic imports detected
What is a pickle import?
11.5 MB
xet
Upload reactivity.zip
7 months ago
ring_planarity.zip
2.45 kB
xet
Upload 2 files
6 months ago
sampling.zip
Safe
pickle
Pickle imports
No problematic imports detected
What is a pickle import?
512 kB
xet
Upload sampling.zip (#6)
6 months ago
scaling.zip
Safe
pickle
Pickle imports
No problematic imports detected
What is a pickle import?
2.2 MB
xet
Upload scaling.zip
7 months ago
small_molecule_minimization.zip
Safe
pickle
Pickle imports
No problematic imports detected
What is a pickle import?
83.6 kB
xet
Update small_mole_min.zip
8 months ago
solvent_radial_distribution.zip
Safe
pickle
Pickle imports
No problematic imports detected
What is a pickle import?
77.7 kB
xet
Upload solvent_radial_distribution.zip
7 months ago
stability.zip
Safe
pickle
Pickle imports
No problematic imports detected
What is a pickle import?
444 kB
xet
Upload stability.zip
7 months ago
tautomers.zip
Safe
pickle
Pickle imports
No problematic imports detected
What is a pickle import?
1.28 MB
xet
Upload tautomers.zip
6 months ago
water_radial_distribution.zip
Safe
pickle
Pickle imports
No problematic imports detected
What is a pickle import?
45.3 kB
xet
Upload water_radial_distribution.zip
7 months ago
