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cadd-automated-workflow

cadd-workflows

diammatics

This repository is for all the scripts related to a type-1 diabetes project at the Sycuro Lab (UofC)

dlscore_test

This repository makes some adjustments on files that are going to be tested by the actual DLSCORE

fastq_validator

Bunch of codes that validate the quality/sequences of .fastq files

ligand-net-workflow

Workflow that works as a shell where the user inputs protein-ligand data to determine whether a ligand is an active or a decoy for that specific protein

ligandnet

LigandNet, a tool which combines different machine learning models into one platform for the prediction of the state of the ligands either actives or inactives for a particular proteins.

pillai_lab

This repository contains the codes I've been developing regarding my binf project with the Pillai lab

pk_extractor

This module will be extracting pharmacokinetic properties from pdf, html and xml files.

rd_filters

A script to run structural alerts using the RDKit and ChEMBL

smina_docking

Here are the results after docking some of the proteins (receptors) from the DUD-E dataset with ligands, both active and decoys.