Standard escape codes are prefixed with Escape
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- Unicode:
\u001b
- Hexadecimal:
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- Decimal:
27
#!/bin/bash | |
# get the filename without the extension | |
JOB=$1 | |
SUBMIT=qsub.tmp | |
PWD=`pwd` | |
cat > $SUBMIT <<!EOF | |
#!/bin/bash |
PY=python3 | |
all: | |
find data -name "*.txt" | ${PY} test.py | |
data: | |
mkdir -p data | |
for x in `seq 1 150`; do echo $$x; ./generate_password.sh > data/$$x.txt; done |
import numpy as np | |
from rdkit import Chem | |
# examples | |
# C=[NH+]C | |
component = "C=[NH+]" | |
component = "[NH+]C" | |
# C[S+](C)C | |
component = "C[S+]" |
#!/bin/bash | |
# Script for installing tmux on systems where you don't have root access. | |
# tmux will be installed in $INSTALL_DIR/local/bin. | |
# It's assumed that wget and a C/C++ compiler are installed. | |
# exit on error | |
set -e | |
TMUX_VERSION=2.3 |
import openbabel | |
# Copyright 2009 TJ O'Donnell | |
class recap: | |
# RECAP-Retrosynthetic Combinatorial Analysis Procedure | |
# J. Chem. Inf. Comput. Sci. 1998, 38, 511-522 | |
def __init__(self, mol, minsize=5): | |
self.mol = mol; | |
# minimum allowed size (atom count) of fragment | |
self.minsize = minsize; | |
# bonded atom pairs populated by the apply method, |