XDL files for synthesising Antiviral drugs with the Chemputer
☆50Apr 7, 2020Updated 6 years ago
Alternatives and similar repositories for ChemputerAntiviralXDL
Users that are interested in ChemputerAntiviralXDL are comparing it to the libraries listed below. We may earn a commission when you buy through links labeled 'Ad' on this page.
Sorting:
- Software for running the Chemputer in association with the supporting publication in Science☆108Jul 28, 2022Updated 3 years ago
- ☆23Nov 18, 2023Updated 2 years ago
- ☆12Mar 12, 2023Updated 3 years ago
- Public code base for the Accelerated Molecular Discovery (AMD) platform☆12Nov 17, 2023Updated 2 years ago
- MVTrans: Multi-view Perception to See Transparent Objects (ICRA2023)☆20Aug 8, 2023Updated 2 years ago
- Managed hosting for WordPress and PHP on Cloudways • AdManaged hosting for WordPress, Magento, Laravel, or PHP apps, on multiple cloud providers. Deploy in minutes on Cloudways by DigitalOcean.
- Tutorial on the usage of Rdkit, Pandas, sklearn, machine learning, descriptor calculation, etc.. in the context of bioactivity predictive…☆14Sep 28, 2014Updated 11 years ago
- AlphaFlow Reinforcement Learning☆10Apr 13, 2023Updated 3 years ago
- IvoryOS – Auto-abstraction & runtime for self-driving labs. Turns Python scripts into a visual workflow builder, execution engine, and op…☆18Updated this week
- Bayesian optimization used for kuka workflow☆20Mar 21, 2023Updated 3 years ago
- ☆23May 8, 2019Updated 7 years ago
- This is an updated version of the MolecularTransformer of Schwaller et. al.☆14Jan 17, 2022Updated 4 years ago
- ☆21Sep 19, 2025Updated 10 months ago
- ☆15Jun 8, 2022Updated 4 years ago
- An Introduction to Optimization Algorithms☆13Dec 26, 2020Updated 5 years ago
- Deploy to Railway using AI coding agents - Free Credits Offer • AdUse Claude Code, Codex, OpenCode, and more. Autonomous software development now has the infrastructure to match with Railway.
- Convergence of multiple synthetic paradigms in a universally programable chemical synthesis machine☆12Feb 9, 2021Updated 5 years ago
- A Python 3 class for communication with serial devices such as hotplate stirrers, vacuum pumps etc.☆15Jun 16, 2021Updated 5 years ago
- hierachical automation of the natural sciences☆24Feb 12, 2025Updated last year
- Create PDF from XML file☆11Apr 27, 2020Updated 6 years ago
- Dynamic Histogram Analysis To Determine Free Energies and Rates from Biased Simulations☆22Mar 13, 2018Updated 8 years ago
- Benchmarking☆34Nov 18, 2021Updated 4 years ago
- Discrete dipole approximation implementation in python☆16Sep 21, 2015Updated 10 years ago
- A simple peristaltic pump, with bearings and 3d printed parts for a NEMA17☆15Oct 2, 2022Updated 3 years ago
- Extracts tables into json format from HTML/XML files☆39May 12, 2020Updated 6 years ago
- Simple, predictable pricing with DigitalOcean hosting • AdAlways know what you'll pay with monthly caps and flat pricing. Enterprise-grade infrastructure trusted by 600k+ customers.
- ARES OS™ is research software to streamline the creation of systems for closed-loop, autonomous experimentation.☆45May 13, 2021Updated 5 years ago
- Useful functions for manipulating Multiplex Assay of Variant Effect datasets.☆11Feb 6, 2025Updated last year
- This project introduces a novel single-step retrosynthesis approach based on chemical compound substructures and fingerprint descriptors.☆19Mar 31, 2021Updated 5 years ago
- Official implementation of "Approximating Gradients for Differentiable Quality Diversity in Reinforcement Learning"☆22Oct 3, 2022Updated 3 years ago
- Slab graph convolutional neural networks for predicting surface-related material properties☆18Oct 6, 2020Updated 5 years ago
- ROS Packages for Omron Mobile Robot☆15Jul 21, 2020Updated 6 years ago
- Blood Transcription Modules for interpreting blood transcriptomics data☆11Nov 25, 2024Updated last year
- Notebook for standardization of actvity data, nonadditivity analysis and its evaluation.☆12Mar 16, 2023Updated 3 years ago
- SMARTS: 'regular expressions' for chemical structures☆24Jun 21, 2018Updated 8 years ago
- Open source password manager - Proton Pass • AdSecurely store, share, and autofill your credentials with Proton Pass, the end-to-end encrypted password manager trusted by millions.
- This repository is the used for teaching the Physical Chemistry Practicum about Molecular Dynamics (MD) simulations for pharmacy and biol…☆12May 7, 2025Updated last year
- ☆23Nov 10, 2020Updated 5 years ago
- ☆10Jul 30, 2024Updated last year
- Data-driven chemical-induced toxicity prediction by machine learning using chemical and bioactivity data☆10Feb 7, 2017Updated 9 years ago
- Masgent: Materials Simulation Agent☆32May 7, 2026Updated 2 months ago
- AlabOS: Managing the workflows in the Autonomous lab☆55Feb 26, 2026Updated 4 months ago
- ☆14Apr 15, 2026Updated 3 months ago