Pinned Repositories
3D-geometric-deep-learning-in-drugs
3D-geometric-deep-learning-in-drugs
COVID-19-GAN
EHIGN_PLA
EHIGN_SBVS
GIGN
LEIGNN
MDGNN
MGraphDTA
ML-DTI
SA-DDI
guaguabujianle's Repositories
guaguabujianle/MGraphDTA
guaguabujianle/GIGN
guaguabujianle/SA-DDI
guaguabujianle/ML-DTI
guaguabujianle/LEIGNN
guaguabujianle/EHIGN_PLA
guaguabujianle/COVID-19-GAN
guaguabujianle/EHIGN_SBVS
guaguabujianle/MDGNN
guaguabujianle/3D-geometric-deep-learning-in-drugs
3D-geometric-deep-learning-in-drugs
guaguabujianle/DeepRelax
guaguabujianle/EDM-Dock
guaguabujianle/EHIGN
guaguabujianle/Graph-Neural-Networks-in-Life-Sciences
guaguabujianle/Kalman-and-Bayesian-Filters-in-Python
Kalman Filter book using Jupyter Notebook. Focuses on building intuition and experience, not formal proofs. Includes Kalman filters,extended Kalman filters, unscented Kalman filters, particle filters, and more. All exercises include solutions.
guaguabujianle/MDsim
Training and simulating MD with ML force fields
guaguabujianle/NeuralForceField
Neural Network Force Field based on PyTorch
guaguabujianle/Pocket2Mol
Pocket2Mol: Efficient Molecular Sampling Based on 3D Protein Pockets
guaguabujianle/YouTubeVideoCode
Code related to my YouTube vids!