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Update scripts/moo.sh

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  1. scripts/moo.sh +2 -16
scripts/moo.sh CHANGED
@@ -1,25 +1,11 @@
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  export CUDA_VISIBLE_DEVICES=7
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  python -u moo.py \
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- --output_file '/scratch/pranamlab/tong/MOG-DFM/collaboration/FFX.csv' \
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  --length 10 \
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  --n_batches 600 \
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  --weights 1 1 1 4 4 2 \
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  --motifs '16-31,62-79' \
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  --motif_penalty \
 
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  --target_protein MHVPSGAQLGLRPDLLARRRLKRCPSRWLCLSAAWSFVQVFSEPDGFTVIFSGLGNNAGGTMHWNDTRPAHFRILKVVLREAVAECLMDSYSLDVHGGRRTAAG
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-
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- # python -u moo.py \
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- # --output_file '/scratch/pranamlab/tong/MOG-DFM/collaboration/new_GFAP_365-374.csv' \
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- # --length 10 \
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- # --weights 1 1 1 1 1 8 8 \
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- # --motifs '365-374' \
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- # --target_protein MERRRITSAARRSYVSSGEMMVGGLAPGRRLGPGTRLSLARMPPPLPTRVDFSLAGALNAGFKETRASERAEMMELNDRFASYIEKVRFLEQQNKALAAELNQLRAKEPTKLADVYQAELRELRLRLDQLTANSARLEVERDNLAQDLATVRQKLQDETNLRLEAENNLAAYRQEADEATLARLDLERKIESLEEEIRFLRKIHEEEVRELQEQLARQQVHVELDVAKPDLTAALKEIRTQYEAMASSNMHEAEEWYRSKFADLTDAAARNAELLRQAKHEANDYRRQLQSLTCDLESLRGTNESLERQMREQEERHVREAASYQEALARLEEEGQSLKDEMARHLQEYQDLLNVKLALDIEIATYRKLLEGEENRITIPVQTFSNLQIRETSLDTKSVSEGHLKRNIVVKTVEMRDGEVIKESKQEHKDVM
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-
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- # python -u moo.py \
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- # --output_file '/scratch/pranamlab/tong/MOG-DFM/collaboration/new_GFAP_76-79_365-374.csv' \
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- # --length 10 \
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- # --weights 1 1 1 1 1 8 8 \
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- # --motifs '76-79, 365-374' \
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- # --target_protein MERRRITSAARRSYVSSGEMMVGGLAPGRRLGPGTRLSLARMPPPLPTRVDFSLAGALNAGFKETRASERAEMMELNDRFASYIEKVRFLEQQNKALAAELNQLRAKEPTKLADVYQAELRELRLRLDQLTANSARLEVERDNLAQDLATVRQKLQDETNLRLEAENNLAAYRQEADEATLARLDLERKIESLEEEIRFLRKIHEEEVRELQEQLARQQVHVELDVAKPDLTAALKEIRTQYEAMASSNMHEAEEWYRSKFADLTDAAARNAELLRQAKHEANDYRRQLQSLTCDLESLRGTNESLERQMREQEERHVREAASYQEALARLEEEGQSLKDEMARHLQEYQDLLNVKLALDIEIATYRKLLEGEENRITIPVQTFSNLQIRETSLDTKSVSEGHLKRNIVVKTVEMRDGEVIKESKQEHKDVM
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-
 
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  export CUDA_VISIBLE_DEVICES=7
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  python -u moo.py \
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+ --output_file '/scratch/pranamlab/tong/MOG-DFM/collaboration/FFX_test.csv' \
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  --length 10 \
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  --n_batches 600 \
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  --weights 1 1 1 4 4 2 \
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  --motifs '16-31,62-79' \
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  --motif_penalty \
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+ --objectives Hemolysis Non-Fouling Half-Life Affinity Motif Specificity \
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  --target_protein MHVPSGAQLGLRPDLLARRRLKRCPSRWLCLSAAWSFVQVFSEPDGFTVIFSGLGNNAGGTMHWNDTRPAHFRILKVVLREAVAECLMDSYSLDVHGGRRTAAG