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authorNavan Chauhan <navanchauhan@gmail.com>2020-10-03 19:11:04 +0530
committerNavan Chauhan <navanchauhan@gmail.com>2020-10-03 19:11:04 +0530
commit6fe0c3114b33471ae640ec5887f77b2ba33cc35c (patch)
treeec5705c93d18b7958931b451df06cfde01ee42b9 /app/scripts/main.sh
parente300d53d0d7877680fb0eeb2a8d5bcce3d6529e1 (diff)
added title,date to pdf
Diffstat (limited to 'app/scripts/main.sh')
-rwxr-xr-xapp/scripts/main.sh2
1 files changed, 2 insertions, 0 deletions
diff --git a/app/scripts/main.sh b/app/scripts/main.sh
index b1c789c..7ad044c 100755
--- a/app/scripts/main.sh
+++ b/app/scripts/main.sh
@@ -142,6 +142,8 @@ fi
if [[ $interactions == "true" ]]; then
file=$(echo "$ligandPath" | cut -f 1 -d '.')
python3 ./get-best.py -p $proteinPath -l "$(echo $file)_out.pdbqt"
+ echo "Generating SVG of Compound"
+ obabel $ligandPath -O compound.svg
echo "Running PLIP"
plip -f best.pdb -qpxy
echo "Getting Dock Score"