The Computational Geometry Algorithms Library
Graph Neural Networks with Keras and Tensorflow 2
Message Passing Neural Networks for Molecule Property Prediction
Molecular simulation in Julia
Graph-based molecule modeling toolkit for cheminformatics
Framework that is dedicated to making neural data processing
Democratizing Deep-Learning for Drug Discovery, Quantum Chemistry, etc
Virtual Screening software for Computational Drug Discovery
An interactive viewer for three-dimensional chemical structures.
High-performance read alignment, quantification and mutation discovery
2D molecule editor
Scoring and Minimization with AutoDock Vina
Processing and analysis of Small Angle X-ray Scattering (SAXS) data.
A software package for processing and analyzing chemical trajectories
kSNP4 does SNP discovery and SNP annotation from whole genomes
vmdStore provides a user-friendly interface to free install VMD plugin
Analysis, visualization, edition of 3D atomistic models
Molecular viewer and prototyping framework
ShelXle is a Qt GUI for SHELXL