Lucien Walewski

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New activity in InstaDeepAI/MLIPAudit-data about 23 hours ago

Add inference_speed.zip (repack/rename of scaling dataset)

#28 opened about 23 hours ago by

lcolonn

Remove orphaned sampling.zip (data merged into folding_stability.zip)

#27 opened about 23 hours ago by

lcolonn

Update folding_stability.zip: villin + shared sampling data (flat layout)

#26 opened 1 day ago by

lcolonn

New activity in InstaDeepAI/MLIPAudit-data 4 days ago

feat: add reference unsolvated villin

#25 opened 4 days ago by

lcolonn

fix: villin pdb file name

#24 opened 4 days ago by

lcolonn

New activity in InstaDeepAI/MLIPAudit-data 22 days ago

Use equilibriated CCl4

#23 opened 22 days ago by

lcolonn

Update molecular liquids

#22 opened 23 days ago by

lcolonn

New activity in InstaDeepAI/MLIPAudit-data about 1 month ago

Upload nve_energy_conservation.zip

#20 opened about 1 month ago by

mbortone

Upload folding_stability.zip

#19 opened about 1 month ago by

leonwehrhan

New activity in InstaDeepAI/MLIPAudit-data 2 months ago

Upload folmsbee_dataset.json

#16 opened 2 months ago by

leonwehrhan

feat: add folmsbee to conformer selection

#17 opened 2 months ago by

lcolonn

New activity in InstaDeepAI/mlipaudit-results 8 months ago

feat: update visnet-spice2-t1x biomolecules

#6 opened 8 months ago by

lcolonn

feat: half visnet-spice2-t1x fs trajectories

#5 opened 8 months ago by

lcolonn

feat: update scores

#4 opened 8 months ago by

lcolonn

feat: update sampling results

#3 opened 8 months ago by

lcolonn

New activity in InstaDeepAI/MLIPAudit-data 8 months ago

update-biomolecules

#15 opened 8 months ago by

lcolonn

New activity in InstaDeepAI/MLIPAudit-data 10 months ago

Upload nudged_elastic_band.zip

#12 opened 10 months ago by

leonwehrhan

Upload bond_length_distribution.zip

#14 opened 10 months ago by

leonwehrhan

New activity in InstaDeepAI/mlipaudit-results 10 months ago

remove-dev-models

#2 opened 10 months ago by

lcolonn

New activity in InstaDeepAI/mlipaudit-leaderboard 10 months ago

remove-dev-models

#1 opened 10 months ago by

lcolonn