Implementation of "TransPolymer: a Transformer-based language model for polymer property predictions" in PyTorch
☆97Nov 17, 2023Updated 2 years ago
Alternatives and similar repositories for TransPolymer
Users that are interested in TransPolymer 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 benchmark dataset for polymer informatics.☆108May 31, 2021Updated 5 years ago
- The repository for the generative pretrained model on polymer generation☆23Mar 20, 2026Updated 7 months ago
- ADEPT: Automated molecular Dynamics Engine for Polymer simulaTions☆17Jun 27, 2026Updated 4 months ago
- Code for "Inverse Design of Copolymers Including Stoichiometry and Chain Architecture"☆13Nov 19, 2025Updated 11 months ago
- Unified machine learning model for predicting polymer properties through human language instructions☆35May 6, 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.
- Large language models, physics-based modeling, experimental measurements: the trinity of data-scarce learning of polymer properties☆15Sep 4, 2025Updated last year
- Reinforcement Learning-Guided Polymer Gen- eration for Multi-Objective Gas Membrane Discovery☆16Jun 5, 2026Updated 4 months ago
- ☆15Dec 2, 2022Updated 3 years ago
- Polymer property prediction with GNNs and deep set learning.☆34May 31, 2023Updated 3 years ago
- Generator of SMILES string from bigSMILES with extension☆36May 15, 2025Updated last year
- 1st place solution to the "NeurIPS - Open Polymer Prediction 2025" Kaggle competition☆13Sep 29, 2025Updated last year
- Tool for the canonicalization of Polymer SMILES (P🙂) strings☆37Sep 3, 2024Updated 2 years ago
- Well-trained models and generative outcomes for the paper "Benchmarking Study of Deep Generative Models for Inverse Polymer Design"☆12Aug 8, 2025Updated last year
- Message Passing Neural Networks for Molecule Property Prediction☆52Oct 12, 2022Updated 4 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.
- ☆30Feb 13, 2025Updated last year
- ☆13May 13, 2022Updated 4 years ago
- rule-based virtual polymer library generator☆56Dec 23, 2025Updated 10 months ago
- Automated BigSMILES conversion workflow and dataset for homopolymeric macromolecules☆21Jun 9, 2024Updated 2 years ago
- ☆12Jul 4, 2025Updated last year
- ☆10Oct 18, 2023Updated 3 years ago
- A machine-learning implementation that learns generalizable, interpretable models connecting polymer chemistry to membrane gas permeabili…☆45Jun 1, 2025Updated last year
- ☆13Feb 4, 2025Updated last year
- ☆23Feb 16, 2024Updated 2 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.
- ☆33May 14, 2025Updated last year
- Differentiable Electrochemistry Simulation Supporting Diffusion, Migration and Convection☆13Oct 22, 2026Updated last week
- RadonPy is a Python library to automate physical property calculations for polymer informatics.☆290Oct 13, 2026Updated 3 weeks ago
- A Python library for prediction of polymeric material properties.☆24May 6, 2022Updated 4 years ago
- [KDD'22] Source codes of "Graph Rationalization with Environment-based Augmentations"☆48Mar 27, 2025Updated last year
- [CIKM2024] The official implementation of "MMPolymer: A Multimodal Multitask Pretraining Framework for Polymer Property Prediction"☆39Aug 20, 2025Updated last year
- Config files for my GitHub profile.☆15Oct 28, 2025Updated last year
- Building MD simulations for polymer electrolyte system☆15Oct 6, 2025Updated last year
- Augmenting Polymer Datasets via Iterative Rearrangement☆13Jun 30, 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.
- ☆38Jul 18, 2025Updated last year
- ☆11Mar 14, 2025Updated last year
- Supplementary Data for "A graph representation of molecular ensembles for polymer property prediction"☆25Oct 12, 2022Updated 4 years ago
- AI-Guided Inverse Design and Discovery of Recyclable Vitrimeric Polymers: https://doi.org/10.1002/advs.202411385☆12Oct 18, 2025Updated last year
- Code for the paper Copolymer Informatics with Multi-Task Deep Neural Networks☆15Sep 3, 2024Updated 2 years ago
- Convert SMILES (chemical structure) to one-hot matrix.☆10Jan 27, 2021Updated 5 years ago
- polyVERSE is a comprehensive repository of informatics-ready datasets curated by the Ramprasad Group.☆47Oct 27, 2026Updated last week