Repo to build AF models of endogeneous ligands

🔗💊 Visualisation of Contact Network of GPCR in 2D schematic model

Lit review of opioid receptor using molecular dynamics

Simulation of pharmacodynamic models of drug-GPCR (class A) interactions.

An ML-based predictor of GPCR/G-protein couplings using only sequence information

Code for an artificial neural net classifier of small molecule GPCR activity

PrimaryOdors.org molecular docker.

A predictor of GPCR couplings with G-proteins/B-arrs using Transformers

GPCRs modeling and docking with python

mdciao: Accessible Analysis and Visualization of Molecular Dynamics Simulation Data

This repository is the collection point of reference data for the GPCRdb. The GPCRdb contains reference data, interactive visualisation and experiment design tools for G protein-coupled receptors (GPCRs).

Protwis is the backbone of the GPCRdb. The GPCRdb contains reference data, interactive visualisation and experiment design tools for G protein-coupled receptors (GPCRs).