yangkevin2 / coronavirus_dataLinks
☆81Updated last year
Alternatives and similar repositories for coronavirus_data
Users that are interested in coronavirus_data are comparing it to the libraries listed below
Sorting:
- Energy-based models for atomic-resolution protein conformations☆98Updated 3 years ago
- Interpreting graph convolutional filters of target prediction network☆48Updated 6 years ago
- ☆63Updated 6 years ago
- Chemical Property Prediction with Graph Convolutional Networks☆60Updated 5 years ago
- Predicting Organic Reaction Outcomes with Weisfeiler-Lehman Network (NIPS 2017)☆152Updated 6 years ago
- ☆59Updated 6 years ago
- Hierarchical Inter-Message Passing for Learning on Molecular Graphs☆79Updated 3 years ago
- Molecular Generation for Desired Transcriptome Changes with Adversarial Autoencoders☆53Updated 4 years ago
- Learning Multimodal Graph-to-Graph Translation for Molecular Optimization (ICLR 2019)☆149Updated 6 years ago
- GraphNVP: An Invertible Flow Model for Generating Molecular Graphs☆93Updated 3 years ago
- Code for the paper "A Deep Generative Model for Fragment-Based Molecule Generation" (AISTATS 2020)☆66Updated 2 years ago
- Code and data for "NeVAE: A Deep Generative Model for Molecular Graphs", AAAI 2019☆54Updated 5 years ago
- MoleculeNet benchmark dataset & MolMapNet dataset☆64Updated 3 years ago
- Code for paper "TrimNet: learning molecular representation from triplet messages for biomedicine "☆53Updated 2 years ago
- Data and models (with prediction scripts) used in publications related to Apollo1060 platform☆64Updated last year
- Literature of deep learning for graphs in Chemistry and Biology☆201Updated 4 years ago
- The official implementation of the Molecule Attention Transformer.☆247Updated 5 years ago
- PyTorch library of layers acting on protein representations☆119Updated last year
- Multi-Objective Molecule Generation using Interpretable Substructures (ICML 2020)☆155Updated 2 years ago
- ☆67Updated 3 years ago
- source code for https://arxiv.org/abs/2005.11248 "Accelerating Antimicrobial Discovery with Controllable Deep Generative Models and Molec…☆102Updated 2 years ago
- ☆167Updated 3 years ago
- Mol-CycleGAN - a generative model for molecular optimization☆75Updated 6 years ago
- Fréchet ChemNet Distance: A quality measure for generative models for molecules☆82Updated last year
- FS-Mol is A Few-Shot Learning Dataset of Molecules, containing molecular compounds with measurements of activity against a variety of pr…☆168Updated 2 years ago
- ☆98Updated 5 years ago
- An up-to-date list of papers and code relating to progress in the burgeoning field of AI-Drug Discovery☆43Updated 5 years ago
- Baselines models for GuacaMol benchmarks☆141Updated last year
- ProteinGCN: Protein model quality assessment using Graph Convolutional Networks☆117Updated 11 months ago
- Database of Interacting Protein Structures (DIPS)☆102Updated last year