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@lsauer
lsauer / InChi.js
Created October 25, 2011 14:13
Regular Expressions for validating SMILES, InChi, InChiKey
// International Chemical Identifier Regex, by lo sauer - lsauer.com
// Morphine InchI:
var x="InChI=1S/C17H19NO3/c1-18-7-6-17-10-3-5-13(20)16(17)21-15-12(19)4-2-9(14(15)17)8-11(10)18/h2-5,10-11,13,16,19-20H,6-8H2,1H3/t10-,11+,13-,16-,17-/m0/s1"
// applying an organic character-subset
// we could check for the length property, but in case of 0 matches 'null' is returned -> hence !!.. \ generally equal to Boolean(..)
!!x.trim().match(/^((InChI=)?[^J][0-9BCOHNSOPrIFla+\-\(\)\\\/,pqbtmsih]{6,})$/ig)
>true
//generic:
x.trim().match(/^((InChI=)?[^J][0-9a-z+\-\(\)\\\/,]+)$/ig)
@rxaviers
rxaviers / gist:7360908
Last active July 6, 2024 10:01
Complete list of github markdown emoji markup

People

:bowtie: :bowtie: 😄 :smile: 😆 :laughing:
😊 :blush: 😃 :smiley: ☺️ :relaxed:
😏 :smirk: 😍 :heart_eyes: 😘 :kissing_heart:
😚 :kissing_closed_eyes: 😳 :flushed: 😌 :relieved:
😆 :satisfied: 😁 :grin: 😉 :wink:
😜 :stuck_out_tongue_winking_eye: 😝 :stuck_out_tongue_closed_eyes: 😀 :grinning:
😗 :kissing: 😙 :kissing_smiling_eyes: 😛 :stuck_out_tongue:
<?xml version="1.0" encoding="UTF-8" standalone="yes" ?>
<CodeBlocksConfig version="1">
<editor>
<colour_sets>
<ACTIVE_COLOUR_SET>
<str>
<![CDATA[modnokai night shift v2]]>
</str>
</ACTIVE_COLOUR_SET>
<ACTIVE_LANG>
@yavallejo
yavallejo / OpenWithSublimeText3.bat
Last active January 26, 2018 20:13 — forked from mrchief/LICENSE.md
Add menu contextual folder With Sublime Text 3
@echo off
SET st2Path=C:\Program Files\Sublime Text 3\sublime_text.exe
rem add it for all file types
@reg add "HKEY_CLASSES_ROOT\*\shell\Open with Sublime Text 3" /t REG_SZ /v "" /d "Open with Sublime Text 3" /f
@reg add "HKEY_CLASSES_ROOT\*\shell\Open with Sublime Text 3" /t REG_EXPAND_SZ /v "Icon" /d "%st2Path%,0" /f
@reg add "HKEY_CLASSES_ROOT\*\shell\Open with Sublime Text 3\command" /t REG_SZ /v "" /d "%st2Path% \"%%1\"" /f
rem add it for folders
@reg add "HKEY_CLASSES_ROOT\Folder\shell\Open with Sublime Text 3" /t REG_SZ /v "" /d "Open with Sublime Text 3" /f
@ramalho
ramalho / coro_life.py
Last active June 10, 2024 06:20
John Conway's Game of Life implemented with coroutines, by Brett Slatkin
#!/usr/bin/env python3
# Copyright 2014 Brett Slatkin, Pearson Education Inc.
#
# Licensed under the Apache License, Version 2.0 (the "License");
# you may not use this file except in compliance with the License.
# You may obtain a copy of the License at
#
# http://www.apache.org/licenses/LICENSE-2.0
#
@mwaskom
mwaskom / seaborn_dark_background.ipynb
Created December 3, 2015 19:49
Use seaborn with a dark background, if you like that sort of thing.
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@Lakerfield
Lakerfield / index.html
Last active January 11, 2024 15:36
Print ZPL from browser
<!doctype html>
<html lang="en">
<head>
<title>Print ZPL from browser</title>
</head>
<body>
<h1>Test page for print ZPL from browser!</h1>
<script type="text/javascript">
function printZpl(zpl) {
@SamStudio8
SamStudio8 / http-get-dos.conf
Created June 7, 2016 01:43
Simple fail2ban DOS jail
# Fail2Ban configuration file
#
# NOTE
# You should set up in the jail.conf file, the maxretry and findtime carefully in order to avoid false positives.
#
# Author: http://www.go2linux.org
# Modified by: samnicholls.net
# * Mon 6 Jun 2016 - Updated failregex to capture HOST group correctly
[Definition]
@dlstadther
dlstadther / example_etl.py
Last active January 30, 2023 14:47
Example ETL Using Luigi
# import python core modules
import datetime
import logging
# import external modules
import pandas as pd
import requests
# import luigi modules
import luigi
@tomsing1
tomsing1 / luigi_first_steps.md
Last active June 19, 2024 21:52
First steps with the Luigi workflow manager

First steps with the Luigi workflow manager

As an introduction into Luigi, I am following this tutorial with some modifications, e.g. installation using conda.

The problems and solutions described in the examples below have led to the development of sciluigi,