PrimaryOdors.org molecular docker.

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).

mdciao: Accessible Analysis and Visualization of Molecular Dynamics Simulation Data

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

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

GPCRs modeling and docking with python

Repo to build AF models of endogeneous ligands

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

Lit review of opioid receptor using molecular dynamics

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

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