Leon Wehrhan

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New activity in InstaDeepAI/MLIPAudit-data 3 months ago

Upload bond_length_distribution.zip

#14 opened 3 months ago by

leonwehrhan

Upload bond length, ring planarity and small molecule minimization

#13 opened 3 months ago by

leonwehrhan

Upload small_molecule_minimization.zip

#9 opened 3 months ago by

leonwehrhan

Upload 2 files

#8 opened 3 months ago by

leonwehrhan

Upload nudged_elastic_band.zip

#12 opened 3 months ago by

leonwehrhan

Upload stability.zip

#11 opened 3 months ago by

leonwehrhan

Upload folding_stability.zip

#10 opened 3 months ago by

leonwehrhan

remove 2bqv

#7 opened 3 months ago by

leonwehrhan

Upload sampling.zip

#6 opened 3 months ago by

leonwehrhan

New activity in InstaDeepAI/MLIPAudit-data 5 months ago

Upload noncovalent_interactions.zip

#5 opened 5 months ago by

leonwehrhan