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atc

Anatomical Therapeutic Codes (ATC) are a drug classification system which is extensively used in the field of drug development research.

autodock

Molecular Docking Tools

autodock-1

Autodock. The docker container automation tool.

autodock_vina_tools

Galaxy tools for docking protein-ligands. :pill::microscope::books:

binf-project

Network Analysis of Disease Gene Expression to Identify Potential Drug Repositioning

cleanehr

Essential tools and utility functions to facilitate the data processing pipeline, data cleaning and data analysing of clinical data from CC-HIC

cmapm

Connectivity Map analysis in MATLAB

cmldr

A novel drug repositioning computational method

cogena

co-expressed gene-set enrichment analysis

deepchem

Democratizing Deep-Learning for Drug Discovery, Quantum Chemistry, Materials Science and Biology

disease-drug-score

We create a graph using the free online databases DisGeNET and DGIdb. The user is able to execute the R code with one argument (disease name as found in the DisGeNET_xxxxxxxx.txt) in order to find out a sorted list of potential related drugs through the common disease-drug genes.

docking-scripts

Scripts used for virtual screening of small molecule inhibitors from ZINC database using Autodock Vina

dockit-vina

A Python/bash wrapped CLI tool to perform high-throughput molecular docking using AutoDock Vina.

download

🔴蓝灯最新版本下载 https://github.com/getlantern/download 🔴 Lantern Latest Download https://github.com/getlantern/lantern/releases/tag/latest 🔴

drug-repositioning-in-python-using-cmap

Drug Repositioning using Cmap and FDA approval for Drug

drug-target

Summer 2014 project for drug-target pathway analysis

drug_repo

Drug repositioning

drugs-related-data-cleaning

Drug-disease interaction data preparation and preprocessing

drugsideeffects

Drugs with similar side-effects are potential candidates for use elsewhere, the supposition is that similar side-effects may be caused by drugs targeting similar proteins.

ehr

A collection of R functions designed to facilitate the interaction with and analysis of EHR data

faers

Working with public FDA Adverse Event Reporting Data to identify drug, side-effect associations

gene2drug

A toolbox to find if gene sets and drugs are meaningfully related [in development]

getbox-pymol-plugin

A PyMOL Plugin for calculating docking box for LeDock, AutoDock and AutoDock Vina.

gift

An algorithm called GIFT to infer the chemogenmic information based on drug-protein interactions

grep

GREP: Genome for REPositioning drugs

grinn

a Graph database and R package for omic data integration

mbirw

oddt-pdbqt

Script for converting a receptor in any input format to AutoDock's .pdbqt format

predictdrugs_cmaplincs

Screen CMAP and LINCS for drugs predicted against disease

python-normalize-zscore

Data normalization using z-score