Data for our paper "Chemical Reaction Practicality Judgment via Deep Symbol Artificial Intelligence"
☆24Aug 4, 2023Updated 2 years ago
Alternatives and similar repositories for data_for_chem
Users that are interested in data_for_chem are comparing it to the libraries listed below. We may earn a commission when you buy through links labeled 'Ad' on this page.
Sorting:
- ☆14Aug 5, 2024Updated last year
- ☆17Feb 5, 2024Updated 2 years ago
- ☆12Jun 14, 2022Updated 3 years ago
- Frontend for evaluating humans on chemistry questions☆11Sep 1, 2024Updated last year
- Text mining of chemical reactions☆113Nov 10, 2024Updated last year
- 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.
- Multi-Step Retrosynthesis Tool based on Augmented Disconnection Aware Triple Transformer Loop Predictions☆27Jul 2, 2024Updated last year
- Augmenting Polymer Datasets via Iterative Rearrangement☆13Jun 30, 2023Updated 2 years ago
- Auto-regressive causal language model for molecule (SMILES) and reaction template (SMARTS) generation based on the Hugging Face implement…☆18Jun 1, 2024Updated last year
- ☆13May 23, 2021Updated 4 years ago
- Findings of ACL 2021☆24May 8, 2021Updated 4 years ago
- ☆23Dec 4, 2024Updated last year
- Uncertainty-aware prediction of chemical reaction yields with graph neural networks☆25Oct 25, 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 3 years ago
- ☆20Sep 17, 2021Updated 4 years ago
- Managed Kubernetes at scale on DigitalOcean • AdDigitalOcean Kubernetes includes the control plane, bandwidth allowance, container registry, automatic updates, and more for free.
- Analyzing chemical databases and predicting reaction conditions with cheminformatics☆48Jul 23, 2025Updated 8 months ago
- CircRNA testing and ploting R package☆10Nov 23, 2020Updated 5 years ago
- Code for DBellQuant☆34Jan 30, 2026Updated last month
- Official code repo for the paper "ChemToolAgent: The Impact of Tools on Language Agents for Chemistry Problem Solving" (previously "Tooli…☆19Jun 7, 2025Updated 9 months ago
- [ACL'21] Dialogue Response Selection with Hierarchical Curriculum Learning☆21Nov 15, 2022Updated 3 years ago
- 3D molecular fingerprints (E3FP) paper repo☆14Mar 14, 2021Updated 5 years ago
- Accelerating Bayesian reaction optimization with limited data☆12Aug 5, 2023Updated 2 years ago
- Chemical reaction data cleaning☆31Apr 19, 2022Updated 3 years ago
- Utilities for working with datasets of chemical reactions, reaction templates and template extraction.☆90Feb 9, 2026Updated last month
- Managed Database hosting by DigitalOcean • AdPostgreSQL, MySQL, MongoDB, Kafka, Valkey, and OpenSearch available. Automatically scale up storage and focus on building your apps.
- ReTReK: data-driven ReTrosynthesis planning application using Retrosynthesis Knowledge☆35Jul 12, 2023Updated 2 years ago
- Code for our EMNLP 2020 paper "Uncertainty-Aware Label Refinement for Sequence Labeling"☆22Oct 4, 2020Updated 5 years ago
- ☆14Apr 15, 2024Updated last year
- Examples of OpenArm simulation☆18Jul 25, 2025Updated 8 months ago
- Energy-based modeling of chemical reactions☆35Dec 15, 2022Updated 3 years ago
- Schema for the Open Reaction Database☆109Jul 3, 2025Updated 8 months ago
- Retrosynthesis Prediction with an Iterative String Editing Model☆30Dec 27, 2024Updated last year
- Retrosynthesis reaction prediction using Transformer sequence to sequence models and SMILES based data augmentation☆67Sep 9, 2019Updated 6 years ago
- ☆21Jun 3, 2021Updated 4 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.
- ☆14Jul 7, 2023Updated 2 years ago
- Compressed Graph Representation for Scalable Molecular Graph Generation☆11Sep 24, 2020Updated 5 years ago
- Modern Hopfield Network (MHN) for template relevance prediction☆48Sep 4, 2023Updated 2 years ago
- Contrastive pretraining to learn chemical reaction representations (RxnRep) for downstream tasks.☆34Aug 10, 2022Updated 3 years ago
- ☆11Oct 10, 2024Updated last year
- Tools to train synthesis prediction models☆29Feb 11, 2026Updated last month
- MSTGAN is an innovative method designed for multi-station urban air quality prediction, which fully considers the individual, global, and…☆20Jul 13, 2024Updated last year