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Datasets:
jglaser
/
binding_affinity
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14
Modalities:
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Size:
1M - 10M
Tags:
molecules
chemistry
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Croissant
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2
5a93178
binding_affinity
/
dude.slurm
jglaser
add dude processing scripts
8c24393
over 3 years ago
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154 Bytes
#!/bin/bash
#SBATCH -J preprocess_dude
#SBATCH -p gpu
#SBATCH -A STF006
#SBATCH -t 3:00:00
#SBATCH -N 8
#SBATCH --ntasks-per-node=16
srun python dude.py