Source code for the paper 'FARM: Functional Group-Aware Representations for Small Molecules
☆16Sep 18, 2025Updated 6 months ago
Alternatives and similar repositories for farm_molecular_representation
Users that are interested in farm_molecular_representation are comparing it to the libraries listed below. We may earn a commission when you buy through links labeled 'Ad' on this page.
Sorting:
- ☆20Nov 24, 2025Updated 4 months ago
- A Graph Neural Network for molecular property prediction with four levels of Interpretability.☆32Feb 26, 2026Updated last month
- Open Source, Prepare a molecular dynamic simulation from scratch without installing local VMD, use LigParGen for topology, it is one of t…☆13Jul 3, 2023Updated 2 years ago
- ChatGPT solutions for the MLE interview☆14Dec 9, 2022Updated 3 years ago
- Source code for the paper "Structured Attention Graphs for Understanding Deep Image Classifications"☆32Dec 18, 2021Updated 4 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.
- NNVisBuilder and some cases including KD-t☆12Nov 18, 2023Updated 2 years ago
- Intro To Bayesian Networks☆11Aug 25, 2016Updated 9 years ago
- TopoTrans: Optimal Transport meets Topological Data Analysis☆14Apr 20, 2023Updated 2 years ago
- A light-weight PyTorch extension for equivariant deep learning☆18Feb 20, 2025Updated last year
- Top-tier conference papers on out-of-distribution detection☆11Jun 22, 2023Updated 2 years ago
- ☆13Feb 6, 2025Updated last year
- 采用Go语言,配置中心etcd、消息中间件Kafka、搜索引擎ElasticSearch、时序数据库、InfluxDB以及可视化平台Kibana、Grafana开发的日志收集系统☆12Oct 29, 2022Updated 3 years ago
- DeepSPIN method for deep learning potential of magnetic systems☆18Jun 4, 2023Updated 2 years ago
- Data and analysis scripts for understanding molecular entropies, including conformer flexibility☆13Mar 29, 2021Updated 5 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.
- Tool to fetch, parse, and standardize materials data from various databases for LeMaterial.☆18Mar 12, 2026Updated 3 weeks ago
- ☆13Nov 16, 2023Updated 2 years ago
- Go-Zero 短链项目 DevOps 实战,利用 Drone CI/CD 打通上云(Kubernetes)迭代流程☆15Dec 31, 2020Updated 5 years ago
- DFT dataset and machine learning models for high entropy alloys☆24Apr 19, 2024Updated last year
- Computational tools for simulation of high-entropy alloy surfaces☆19Jun 17, 2025Updated 9 months ago
- ☆12May 12, 2025Updated 10 months ago
- ☆12May 20, 2020Updated 5 years ago
- SOTA work about out-of-distribution detection☆14Mar 5, 2021Updated 5 years ago
- ☆31Jan 20, 2026Updated 2 months ago
- Proton VPN Special Offer - Get 70% off • AdSpecial partner offer. Trusted by over 100 million users worldwide. Tested, Approved and Recommended by Experts.
- Sonar simulator considering reverberation, noise, etc☆11Aug 7, 2020Updated 5 years ago
- This is the official implementation of "Motif-based Graph Representation Learning with Application to Chemical Molecules".☆11Feb 10, 2023Updated 3 years ago
- [AAAI-23] Improving Pareto Front Learning via Multi-Sample Hypernetworks☆10Aug 22, 2024Updated last year
- Introduction to Deep Learning☆11Mar 25, 2021Updated 5 years ago
- ☆18Mar 31, 2024Updated 2 years ago
- Web site for Shiny Developer Series☆10Oct 4, 2025Updated 6 months ago
- ☆26Nov 12, 2025Updated 4 months ago
- Signaling Pathway Visualizer☆10Jun 22, 2019Updated 6 years ago
- 🌸 A collection of Vietnamese women who are currently working in the field of Computer Science.☆15Mar 10, 2026Updated 3 weeks ago
- Managed Database hosting by DigitalOcean • AdPostgreSQL, MySQL, MongoDB, Kafka, Valkey, and OpenSearch available. Automatically scale up storage and focus on building your apps.
- Structure Generator based on R-Group (SGRG)☆10Sep 28, 2019Updated 6 years ago
- Some recommendation algorithms and research☆12Sep 16, 2016Updated 9 years ago
- ☆15Oct 15, 2019Updated 6 years ago
- tools to perform group contribution (GC) identification, given the SMILES of a compound☆21Mar 31, 2026Updated last week
- A publishing website of a table collecting meta-learning-related papers in the area of human language processing.☆17Aug 2, 2021Updated 4 years ago
- Example using R on Amazon ec2☆11Jun 22, 2020Updated 5 years ago
- PhenomeXcan: mapping the genome to the phenome through the transcriptome☆11Jun 28, 2020Updated 5 years ago