Pinned Repositories
aiexperiments-ai-duet
A piano that responds to you.
aizynthfinder
A tool for retrosynthetic planning
chemical_vae
Code for 10.1021/acscentsci.7b00572, now running on Keras 2.0 and Tensorflow
ChromagramSample
Sample codes of displaying Spectrogram and estimating chord progression of sample music audio.
DetectiveConan-Database
名探偵コナン編纂室のページから登場キャラなどのデータを取得する
DetectiveConan_graphviz
GAT_practice
GAT（Graph Attention Network）モデルの導入
harmony_practice_app
L40S38's Repositories
L40S38/DetectiveConan-Database
名探偵コナン編纂室のページから登場キャラなどのデータを取得する
L40S38/aizynthfinder
A tool for retrosynthetic planning
L40S38/chemical_vae
Code for 10.1021/acscentsci.7b00572, now running on Keras 2.0 and Tensorflow
L40S38/DetectiveConan_graphviz
L40S38/GAT_practice
GAT（Graph Attention Network）モデルの導入
L40S38/harmony_practice_app
L40S38/coding-interview-university
A complete computer science study plan to become a software engineer.
L40S38/DeeplyTough
DeeplyTough: Learning Structural Comparison of Protein Binding Sites
L40S38/DeepPocket
Ligand Binding Site detection using Deep Learning
L40S38/DevYouTubeList
List of Development YouTube Channels
L40S38/e3nn_figures
L40S38/egnn-pytorch
Implementation of E(n)-Equivariant Graph Neural Networks, in Pytorch
L40S38/Graphsite-classifier
Ligand-binding site classification with deep graph neural networks.
L40S38/hgraph2graph
Hierarchical Generation of Molecular Graphs using Structural Motifs
L40S38/hpsc-2023
L40S38/IFP-RNN
A molecule generative model used interaction fingerprint (docking pose) as constraints.
L40S38/keras-yolo3
A Keras implementation of YOLOv3 (Tensorflow backend)
L40S38/Meeko
Interfacing RDKit and AutoDock
L40S38/mol-vae-pytorch
L40S38/mol2vec_notebooks
Mol2vec notebooks for use with Binder service
L40S38/p2rank
P2Rank: Protein-ligand binding site prediction tool based on machine learning. Stand-alone command line program / Java library for predicting ligand binding pockets from protein structure.
L40S38/pdb-tools
A dependency-free cross-platform swiss army knife for PDB files.
L40S38/Pocket2Drug
Pytorch implementation of Pocket2Drug: a generative deep learning model to predict binding drugs for ligand-binding sites.
L40S38/Pointnet_Pointnet2_pytorch
PointNet and PointNet++ implemented by pytorch (pure python) and on ModelNet, ShapeNet and S3DIS.
L40S38/PointSite
PointSite: a point cloud segmentation tool for identification of protein ligand binding atoms
L40S38/ScanNet
L40S38/SIEVE-Score
SIEVE-Score: interaction energy-based virtual screening method based on random forest.
L40S38/SparseConvNet
Submanifold sparse convolutional networks
L40S38/vnegnn
L40S38/zinc_downloader
Zinc Database Downloader & Merger