gnina

Results 5 repositories owned by


                                            gnina

561

Stars

140

Forks

Watchers

A deep learning framework for molecular docking

131

Stars

Forks

Watchers

Comprehensive library for fast, GPU accelerated molecular gridding for deep learning workflows

Stars

Forks

Watchers

Trained caffe models

Stars

Forks

Watchers

Stars

Forks

Watchers

Implementation of the SolTranNet tool utilizing the molecular transformer to predict aqueous solubility