Automated Tool for Optimized Modelling
☆164Jul 15, 2024Updated last year
Alternatives and similar repositories for ATOM
Users that are interested in ATOM are comparing it to the libraries listed below. We may earn a commission when you buy through links labeled 'Ad' on this page.
Sorting:
- a catch-all repo☆11Dec 28, 2023Updated 2 years ago
- Flexible Artificial Intelligence Docking☆18Aug 27, 2025Updated 9 months ago
- JSME Molecule Editor ipywidget for jupyter notebook☆12Jul 5, 2025Updated 11 months ago
- Use advanced feature engineering strategies and select best features from your data set with a single line of code. Created by Ram Seshad…☆679Feb 19, 2025Updated last year
- Visualise the Results of Inferential Statistics using 'ggplot2'☆13Jun 12, 2023Updated 3 years ago
- Managed Kubernetes at scale on DigitalOcean • AdDigitalOcean Kubernetes includes the control plane, bandwidth allowance, container registry, automatic updates, and more for free.
- organize data visualization output, automatically picking meaningful names based on semantic plotting variables☆12Apr 21, 2026Updated last month
- LightGBM on Ray☆52Feb 4, 2024Updated 2 years ago
- zoofs is a python library for performing feature selection using a variety of nature-inspired wrapper algorithms. The algorithms range fr…☆253Jan 9, 2026Updated 5 months ago
- UQ4DD: Uncertainty Quantification for Drug Discovery☆18Aug 4, 2025Updated 10 months ago
- A Python toolbox to work with molecular similarity☆44Sep 9, 2025Updated 9 months ago
- advent of code with SQL☆12Dec 16, 2020Updated 5 years ago
- open toolbox for structural comparison☆13Dec 13, 2018Updated 7 years ago
- Implements the blood brain barrier score described in: J. Med. Chem. 2019, 62, 21, 9824-9836 (https://doi.org/10.1021/acs.jmedchem.9b0122…☆14Sep 27, 2020Updated 5 years ago
- A Data Science pipeline for Algorithmic Trading: A comparative study in applications to Finance and cryptoeconomics☆14Jul 1, 2022Updated 3 years ago
- 1-Click AI Models by DigitalOcean Gradient • AdDeploy popular AI models on DigitalOcean Gradient GPU virtual machines with just a single click. Zero configuration with optimized deployments.
- My (small) research project in solubility of drug-like molecules☆17Jan 4, 2021Updated 5 years ago
- ☆17Jan 5, 2023Updated 3 years ago
- A Tree based feature selection tool which combines both the Boruta feature selection algorithm with shapley values.☆657Feb 19, 2024Updated 2 years ago
- Code related to the paper "Time series classification with random convolution kernels: pooling operators and input representations matter…☆15Jan 14, 2026Updated 5 months ago
- This repository is for my master's project, A Survey of Deep Learning Architectures for Algorithmic Cryptocurrency Trading, delivered on …☆10Nov 30, 2022Updated 3 years ago
- Spatiotemporal identification of druggable binding sites using deep learning☆22Mar 16, 2021Updated 5 years ago
- Extra blocks for scikit-learn pipelines.☆1,398Updated this week
- Easiest way to generate counterfactual explanations☆11Sep 26, 2023Updated 2 years ago
- An intuitive library to extract features from time series.☆1,095Jan 30, 2026Updated 4 months ago
- Bare Metal GPUs on DigitalOcean Gradient AI • AdPurpose-built for serious AI teams training foundational models, running large-scale inference, and pushing the boundaries of what's possible.
- VenomPred 2.0 API☆11Feb 4, 2026Updated 4 months ago
- High Information Mapper (HiMap), successor of the Lead Optimization Mapper (LOMAP)☆16May 3, 2023Updated 3 years ago
- Validation for forecasts☆17Mar 5, 2023Updated 3 years ago
- PredictHQ’s Data Science documentation☆15Apr 1, 2026Updated 2 months ago
- Feature engineering and selection open-source Python library compatible with sklearn.☆2,248Jun 4, 2026Updated 2 weeks ago
- Automatically Visualize any dataset, any size with a single line of code. Created by Ram Seshadri. Collaborators Welcome. Permission Gra…☆1,904Jun 10, 2024Updated 2 years ago
- A drop-in replacement for Scikit-Learn’s GridSearchCV / RandomizedSearchCV -- but with cutting edge hyperparameter tuning techniques.☆468Nov 6, 2023Updated 2 years ago
- Code for training and inference for multitask graph convolutional networks☆25Sep 3, 2020Updated 5 years ago
- ☆11Apr 22, 2024Updated 2 years ago
- GPU virtual machines on DigitalOcean Gradient AI • AdGet to production fast with high-performance AMD and NVIDIA GPUs you can spin up in seconds. The definition of operational simplicity.
- MolDesigner: Interactive Design of Efficacious Drugs with Deep Learning (NeurIPS 2020 Demo)☆16Nov 27, 2020Updated 5 years ago
- machine learning model performance metrics & charts with confidence intervals, optimized with numba to be fast☆16Dec 15, 2021Updated 4 years ago
- Code and data for "The Geometry of Classifiers"☆26Jun 22, 2020Updated 5 years ago
- customized dash NGL viewer☆12Jan 6, 2023Updated 3 years ago
- Summary Explorer is a tool to visually explore the state-of-the-art in text summarization.☆45May 13, 2024Updated 2 years ago
- Cookiecutter template for FastAPI + Panel projects in Python☆10Apr 18, 2022Updated 4 years ago
- Format Python code (list of lists) as a fixed width table.☆17Oct 5, 2022Updated 3 years ago