Tutorial for "Advances in machine learning for molecules" (for Summer School for Machine Learning in Bioinformatics, https://cs.hse.ru/ssml/)
☆21Aug 26, 2020Updated 6 years ago
Alternatives and similar repositories for ml-in-bioinformatics-summer-school-2020
Users that are interested in ml-in-bioinformatics-summer-school-2020 are comparing it to the libraries listed below. We may earn a commission when you buy through links labeled 'Ad' on this page.
Sorting:
- The present study is finalised to determine the most advanced models in the literature capable of producing new high-quality molecules st…☆10Aug 31, 2021Updated 5 years ago
- A computational drug discovery project, in which bioinformatic and machine learning tools are used to identify possible molecular targets…☆23Feb 12, 2021Updated 5 years ago
- aligning molecules☆10Apr 24, 2021Updated 5 years ago
- This repository contains a QSAR model that predicts the ability of a chemical compound to inhibit the gene associated with Alzheimer's, B…☆11Oct 1, 2021Updated 5 years ago
- Coloring molecules with explainable artificial intelligence☆16Feb 8, 2021Updated 5 years ago
- Managed Database hosting by DigitalOcean • AdPostgreSQL, MySQL, MongoDB, Kafka, Valkey, and OpenSearch available. Automatically scale up storage and focus on building your apps.
- ☆18Aug 5, 2023Updated 3 years ago
- Source code and data repository for "Ensembles of knowledge graph embedding models improve predictions for drug discovery"☆21Sep 9, 2026Updated last month
- Automatic extraction of interacting compound-target pairs from ChEMBL.☆22Sep 23, 2025Updated last year
- App for serotonergic targets☆12Jan 8, 2026Updated 9 months ago
- Deep learning to solve RNA design puzzles☆20Feb 4, 2025Updated last year
- PDB-CAT aims to automatically categorize the mmCIF PDB structures based on the type of interaction between atoms in the protein and the l…☆16Oct 6, 2026Updated 3 weeks ago
- Data and code required to reach the main conclusions of the fastsmcg paper☆11Sep 19, 2023Updated 3 years ago
- Computational toolbox for virtual High Throughput Screening☆11Jul 11, 2023Updated 3 years ago
- ☆11May 25, 2026Updated 5 months ago
- Serverless GPU API endpoints on Runpod - Get Bonus Credits • AdSkip the infrastructure headaches. Auto-scaling, pay-as-you-go, no-ops approach lets you focus on innovating your application.
- ☆14Oct 9, 2024Updated 2 years ago
- Primer3Web is a simple web interface to primer3.☆17Aug 18, 2021Updated 5 years ago
- List of companies in Switzerland hiring for AI roles. Community edition :)☆15Jan 6, 2026Updated 9 months ago
- A PyMOL plugin with accompanying Docker image for kinase inhibitor binding and affinity prediction☆12Jun 3, 2024Updated 2 years ago
- ☆38May 22, 2024Updated 2 years ago
- Benchmarking active learning protocols for ligand binding affinity prediction☆13Feb 4, 2024Updated 2 years ago
- ☆14Apr 15, 2025Updated last year
- ☆12Feb 17, 2023Updated 3 years ago
- // PROJECT PAUSED FOR NOW (lack of capacity) // Protein cavity identification and automatic subpocket decomposition☆46Jul 23, 2023Updated 3 years ago
- Proton VPN Special Offer - Get 70% off • AdSpecial partner offer. Trusted by over 100 million users worldwide. Tested, Approved and Recommended by Experts.
- An evolutionary probability-based hybrid model to support protein engineering campaigns☆10Sep 3, 2024Updated 2 years ago
- Code to accompany "Practical Cheminformatics With Open Source Software"☆16Feb 24, 2022Updated 4 years ago
- A *minimal* protein structure predictor written in ~200 lines of *readable* PyTorch.☆20Oct 16, 2026Updated last week
- Machine Learning with the Minimum Nescience Principle.☆11Oct 19, 2026Updated last week
- ☆14Jun 23, 2025Updated last year
- ☆25Jul 5, 2023Updated 3 years ago
- Script to facilitate the making of horizontal scripts☆17May 25, 2024Updated 2 years ago
- Self-hosted second brain and operating engine for human and AI workspaces: topology, source evidence, memory, retrieval, agents, tools, w…☆14Updated this week
- Monitorización de alumnos en la plataforma Moodle☆13Sep 23, 2026Updated last month
- 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.
- The practice section of the UNIMI Bioinformatics course☆18Apr 21, 2022Updated 4 years ago
- Conservation analysis of homologous proteins with Python☆13Jul 11, 2021Updated 5 years ago
- collection of random scripts for processing genome related files. the shell scripts are specific to my environment and may not work else…☆10Jul 19, 2018Updated 8 years ago
- Code for reproducing paper describing methods for representing peptides☆18Sep 11, 2026Updated last month
- Aptamers are single-stranded nucleic acid or amino acid polymers that recognize and bind to targets with high affinity and selectivity. …☆16Jun 22, 2020Updated 6 years ago
- Lightweight Python toolkit for molecular structure analysis, visualisation, descriptors, graph export, and coarse-graining.☆14Jun 10, 2026Updated 4 months ago
- Snakemake with pytest example☆11Jul 18, 2020Updated 6 years ago