Img2SMILES generator
☆25Aug 29, 2021Updated 4 years ago
Alternatives and similar repositories for img2smiles_generator
Users that are interested in img2smiles_generator are comparing it to the libraries listed below. We may earn a commission when you buy through links labeled 'Ad' on this page.
Sorting:
- Given an image of a molecule create a smiles or mol represenatation.☆25May 28, 2021Updated 4 years ago
- ☆24Sep 26, 2022Updated 3 years ago
- Input- hand-drawn image of molecule... Output- SMILES format molecule name☆16Apr 23, 2019Updated 6 years ago
- ABC-Net for molecular image recognition☆17Jan 3, 2022Updated 4 years ago
- Python wrapper for OSRA. Supports R-Group logic and integration with ChemSchematicResolver☆10Apr 4, 2020Updated 5 years ago
- Managed Kubernetes at scale on DigitalOcean • AdDigitalOcean Kubernetes includes the control plane, bandwidth allowance, container registry, automatic updates, and more for free.
- Mol2vec notebooks for use with Binder service☆29Mar 24, 2018Updated 8 years ago
- [ICCV 23] MolGrapher: Graph-based Visual Recognition of Chemical Structures☆16Oct 27, 2025Updated 5 months ago
- A feeble attempt at molecular recognition (in the literal sense)☆66Dec 13, 2024Updated last year
- ☆13Jun 9, 2021Updated 4 years ago
- ☆21Oct 2, 2024Updated last year
- Recognising hand-drawn molecules with neural networks☆33Nov 5, 2022Updated 3 years ago
- Blood–Brain Barrier Penetration Prediction Enhanced by Uncertainty Estimation☆12Feb 24, 2022Updated 4 years ago
- HemoPI2: Prediction of hemolytic activity of peptides against mammalian RBCs☆13Feb 10, 2025Updated last year
- Twitter retrosynthesis bot☆13Jul 10, 2022Updated 3 years ago
- DigitalOcean Gradient AI Platform • AdBuild production-ready AI agents using customizable tools or access multiple LLMs through a single endpoint. Create custom knowledge bases or connect external data.
- A Sequence Generation Model for Reaction Diagram Parsing☆109Sep 18, 2023Updated 2 years ago
- A Sequence Generation Model for Reaction Diagram Parsing☆27Jun 30, 2025Updated 8 months ago
- Gromacs molecular dynamics simulation analysis scripts☆10Apr 5, 2022Updated 3 years ago
- DECIMER Image Transformer is a deep-learning-based tool designed for automated recognition of chemical structure images. Leveraging trans…☆350Dec 2, 2025Updated 3 months ago
- Software tools for fragment-based drug discovery (FBDD)☆27Apr 6, 2020Updated 5 years ago
- Overview of published generative models that produce molecules☆15Jan 16, 2020Updated 6 years ago
- This repository contains RanDepict, an easy-to-use utility to generate a big variety of chemical structure depictions (random depiction s…☆30Oct 19, 2023Updated 2 years ago
- ☆13Aug 27, 2020Updated 5 years ago
- Python code and jupyter notebooks to accompany the manuscript "Deep learning models for lipid-nanoparticle-based drug delivery"☆13Jul 28, 2020Updated 5 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.
- ☆17Nov 16, 2018Updated 7 years ago
- For the purpose of post progressing of MD carried by gromacs☆23Jul 2, 2025Updated 8 months ago
- Collection of machine learning models for predicting toxicity of molecules☆12May 6, 2020Updated 5 years ago
- Tool for mining structure-property relationships from chemical datasets☆16Jan 17, 2026Updated 2 months ago
- paper link: https://jcheminf.biomedcentral.com/articles/10.1186/s13321-022-00643-2☆22Sep 27, 2022Updated 3 years ago
- Tensorflow implementation of Generating Focussed Molecule Libraries for Drug Discovery with Recurrent Neural Networks☆29Feb 4, 2019Updated 7 years ago
- Gromacs Implementation of OPLS-AAM Force field☆15Aug 5, 2018Updated 7 years ago
- Recent application of graph neural network in drug discovery☆14Mar 19, 2020Updated 6 years ago
- Notebook for standardization of actvity data, nonadditivity analysis and its evaluation.☆12Mar 16, 2023Updated 3 years ago
- Managed hosting for WordPress and PHP on Cloudways • AdManaged hosting with the flexibility to host WordPress, Magento, Laravel, or PHP apps, on multiple cloud providers. Cloudways by DigitalOcean.
- JavaScript based molecule structure editor☆15Oct 14, 2009Updated 16 years ago
- A repository for the development of data analysis tools for replica exchange molecular dynamics (REMD) simulations☆13Feb 20, 2023Updated 3 years ago
- Image to LaTeX pytorch model☆14Jul 6, 2023Updated 2 years ago
- The semi-unsupervised version of the molecule recognition engine, chemtype.☆19Feb 6, 2019Updated 7 years ago
- Mechanical Turk on your own machine for chemical literature annotation☆13Feb 17, 2022Updated 4 years ago
- Chemical structure detection and segmentation tool for Journal articles.☆138Feb 25, 2026Updated last month
- A Molecular Stereostructure Descriptor based on Spherical Projection☆13Nov 14, 2025Updated 4 months ago