Demonstrator for the effectiveness of transformer models, specifically the newly released ChemBERTa-2, in predicting physical-chemical property endpoints with comparable accuracy to standard machine-learning techniques without the need for descriptor calculation and selection
☆16Mar 1, 2026Updated 4 months ago
Alternatives and similar repositories for LCW-Fine-Tuning-ChemBERTa-2
Users that are interested in LCW-Fine-Tuning-ChemBERTa-2 are comparing it to the libraries listed below. We may earn a commission when you buy through links labeled 'Ad' on this page.
Sorting:
- Resources for Learning Cheminformatics with the RDKit☆19Apr 7, 2019Updated 7 years ago
- Matrix factorization and deep learning for molecular property prediction☆13Apr 4, 2019Updated 7 years ago
- Mirror of the NIST ISODB API (https://adsorption.nist.gov/isodb)☆17Feb 27, 2026Updated 4 months ago
- ☆13Jul 13, 2019Updated 6 years ago
- metallocage construction and binding affinity calculations☆16May 30, 2023Updated 3 years ago
- Virtual machines for every use case on DigitalOcean • AdGet dependable uptime with 99.99% SLA, simple security tools, and predictable monthly pricing with DigitalOcean's virtual machines, called Droplets.
- Official repository accompaying the ICDAR 2023 paper☆14Oct 3, 2023Updated 2 years ago
- Repository holding the code for the drugfindR R package☆11Jun 24, 2026Updated 2 weeks ago
- In process work on active learning tutorials☆10Feb 19, 2024Updated 2 years ago
- Transformer model for structure-agnostic metal-organic frameworks (MOF) property prediction☆64Updated this week
- Repository for the featurization of the NiCOlit reaction dataset and machine learning model training for yield prediction☆14Sep 13, 2022Updated 3 years ago
- Diffusion-based korean text-to-image generation model☆12Aug 16, 2023Updated 2 years ago
- A device-independent random number generator☆18Apr 27, 2024Updated 2 years ago
- ftyuejian / Predicting-CO2-Absorption-in-Ionic-Liquid-with-Molecular-Descriptors-and-Explainable-GNNData and code for Predicting CO2 Absorption in Ionic Liquid with Molecular Descriptors and Explainable Graph Neural☆20Sep 2, 2022Updated 3 years ago
- A set of examples around pytorch in Vision, Text, Reinforcement Learning, etc.☆14Feb 28, 2025Updated last year
- 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.
- Data and code required to reach the main conclusions of the fastsmcg paper☆11Sep 19, 2023Updated 2 years ago
- Interactive plots with chemical structures☆15Nov 14, 2019Updated 6 years ago
- Guided introduction to the Rust programming language.☆18Apr 6, 2021Updated 5 years ago
- 固定框内二维矩形装箱算法,二叉树实现☆11Jul 28, 2022Updated 3 years ago
- Mol2vec notebooks for use with Binder service☆29Mar 24, 2018Updated 8 years ago
- 2nd place solution of ECCV 2020 workshop VIPriors Image Classification Challenge, https://arxiv.org/abs/2008.00261☆13Aug 22, 2021Updated 4 years ago
- This repository is a cloud storage of my new research ideas and interests in Bioinformatics and Computational Biology. Github is a good w…☆17May 30, 2017Updated 9 years ago
- ☆13Apr 12, 2018Updated 8 years ago
- This is the Python code and original data of "Machine-Learning Guided Discovery and Optimization of Additives in Preparing Cu Catalyst fo…☆14Mar 16, 2023Updated 3 years ago
- Wordpress hosting with auto-scaling - Free Trial Offer • AdFully Managed hosting for WordPress and WooCommerce businesses that need reliable, auto-scalable performance. Cloudways SafeUpdates now available.
- Yet another ML method comparison☆16Nov 20, 2022Updated 3 years ago
- Several DNA sequencing algorithms coded in Python: Boyer-Moore, Pigeon Hole, k-mer, Naive, Approximate Matching☆13Oct 19, 2015Updated 10 years ago
- Notebooks for CPA figures☆15Dec 9, 2022Updated 3 years ago
- ☆22Jan 9, 2025Updated last year
- Yunhao Cao's Opensourced Study Notes☆15Aug 19, 2024Updated last year
- 北京大学物理化学实验报告写作的参考模板。☆10Jan 10, 2021Updated 5 years ago
- A TikTok clone using Django + React Native☆12Jun 30, 2024Updated 2 years ago
- A framework for using topological data analysis to extract structure/symmetry from scientific systems.☆26Aug 28, 2022Updated 3 years ago
- Molecular size calculation based on ellipsoid fitting over N conformers☆17Jan 17, 2022Updated 4 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.
- Transformer in Chemical Language Model sometimes misunderstands chirality☆13Apr 19, 2024Updated 2 years ago
- ☆17May 9, 2024Updated 2 years ago
- Zeolite GAN☆28Jun 17, 2020Updated 6 years ago
- Build your own Chat GPT with python. Don't forget to star 🌟 this repository.☆27Jan 21, 2025Updated last year
- Serializing molecule 3D structures☆14Nov 27, 2024Updated last year
- An integrated framework for chemical reaction feasibility prediction. This is a structured solution for one of the Chemistry Challenges o…☆12May 31, 2022Updated 4 years ago
- OpenCode Anthropic Claude OAuth authentication fix guide and setup script☆33Jan 9, 2026Updated 5 months ago