Alternatives and similar repositories for molecule_bond_prediction

Users that are interested in molecule_bond_prediction are comparing it to the libraries listed below

• giotto-ai / the-shape-of-chemical-functions
  ☆12Updated 4 years ago
• awesome-panel / panel-chemistry
  🧪📈 🐍. The purpose of the panel-chemistry project is to make it really easy for you to do DATA ANALYSIS and build powerful DATA AND VI…
  ☆120Updated last year
• whitead / nlcc
  Natural language computational chemistry command line interface.
  ☆45Updated 2 years ago
• johnnyp2587 / transfer-learning
  Implementation of transfer learning based with autoencoder architecture
  ☆17Updated 5 years ago
• scikit-multilearn-ng / scikit-multilearn-ng
  A new maintained "successor" to scikit-multilearn, a scikit-learn based module for multi-label et. al. classification
  ☆22Updated 10 months ago
• JetBrains-Research / pubtrends-review
  Automatic generation of reviews of scientific papers
  ☆31Updated 3 months ago
• ymyke / pypme
  A Python package for PME (Public Market Equivalent) calculation
  ☆12Updated 3 months ago
• mehradans92 / shadyquant
  Shaded 😎 quantile plots
  ☆12Updated 3 years ago
• talsan / stock_news
  Collecting news articles for all the companies in the R1000, for a pre-defined set of news outlets, using Diffbot's Knowledge Graph
  ☆12Updated 2 years ago
• eserie / wax-ml
  A Python library for machine-learning and feedback loops on streaming data
  ☆62Updated 2 years ago
• andfanilo / streamlit-cytoscapejs
  Cytoscape.js wrapper for Streamlit
  ☆31Updated 2 years ago
• knime / knimepy
  ☆47Updated 2 years ago
• schrodinger / gpusimilarity
  A Cuda/Thrust implementation of fingerprint similarity searching
  ☆107Updated last year
• daneads / pypatent
  Search for and retrieve US Patent and Trademark Office Patent Data
  ☆81Updated 5 years ago
• lamm-mit / MateriomicTransformer
  Generative Pretrained Autoregressive Transformer Graph Neural Network applied to the Analysis and Discovery of Materials
  ☆16Updated last year
• lukasturcani / vabene
  Make valid molecular graphs!
  ☆22Updated last year
• dgg32 / bayesian_kg
  ☆24Updated 2 years ago
• lfoppiano / SuperMat
  Superconductors material dataset
  ☆26Updated last year
• microprediction / optimizer-elo-ratings
  Assigns Elo Ratings to Python Global Optimizers
  ☆22Updated last year
• deepchem / torchchem
  An experimental repo for experimenting with PyTorch models
  ☆36Updated 2 years ago
• ryanholbrook / critical-transitions
  Detecting critical transitions in financial networks with topological data analysis.
  ☆16Updated 6 years ago
• choderalab / gimlet
  Graph Inference on MoLEcular Topology
  ☆26Updated 2 years ago
• aspuru-guzik-group / funsies
  funsies is a lightweight workflow engine 🔧
  ☆41Updated 3 years ago
• datavaluepeople / kotsu
  Lightweight framework for structured and repeatable model validation
  ☆11Updated last year
• hetio / hetmatpy
  Python package for matrix storage and operations on hetnets
  ☆15Updated 2 years ago
• automl / learna
  End-to-end RNA Design using deep reinforcement learning
  ☆71Updated 2 years ago
• Ennosigaeon / xautoml
  XAutoML: A Visual Analytics Tool for Understanding and Validating Automated Machine Learning
  ☆35Updated 3 months ago
• dream-faster / krisi
  ⏳ Evaluation of Time-Series Predictions with powerful pdf and web Reporting. Tailored for evaluation of metrics over time!
  ☆23Updated last year
• gcucurull / jax-gcn
  Graph Convolutional Networks in JAX
  ☆32Updated 4 years ago
• fabiorodp / uio_master_thesis
  ☆18Updated 2 years ago