☆62Dec 26, 2022Updated 3 years ago
Alternatives and similar repositories for DRP
Users that are interested in DRP are comparing it to the libraries listed below. We may earn a commission when you buy through links labeled 'Ad' on this page.
Sorting:
- Word2Vec model trained across 640k+ materials science journal articles☆53Sep 14, 2017Updated 8 years ago
- Calculation of power indices (e.g. Banzhaf power index, Shapley-Shubik power index etc)☆18Nov 26, 2025Updated 7 months ago
- Machine learning-guided synthesis of advanced inorganic materials☆10Oct 15, 2019Updated 6 years ago
- Name Reaction Ontology☆49Jun 22, 2026Updated 2 weeks ago
- ☆12Mar 17, 2024Updated 2 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.
- Code repo for the NeurIPS 2021 paper "Online Adaption to Label Distribution Shift".☆16Feb 15, 2023Updated 3 years ago
- Deep Learning Analysis of Defect and Phase Evolution During Electron Beam Induced Transformations in WS2☆13Aug 14, 2018Updated 7 years ago
- ☆11Aug 29, 2022Updated 3 years ago
- Scaffold decoration and fragment linking with chemical language models and RL☆27Mar 24, 2025Updated last year
- Veidt is a deep learning library for materials science.☆18May 5, 2020Updated 6 years ago
- MOOSE Application for simulation of electrodeposition in Li-ion batteries☆21Mar 30, 2022Updated 4 years ago
- ☆27May 22, 2024Updated 2 years ago
- Multimodal Pretraining for Unsupervised Protein Representation Learning☆22Jul 30, 2024Updated last year
- Genetic algorithm for structure and phase prediction interfaced to GULP, LAMMPS and VASP.☆59Sep 25, 2023Updated 2 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.
- cp2k test☆10May 26, 2019Updated 7 years ago
- Explore a state machine mechanism/notation for Simpy☆11May 24, 2022Updated 4 years ago
- Public code base for the Accelerated Molecular Discovery (AMD) platform☆12Nov 17, 2023Updated 2 years ago
- Training materials☆21Dec 3, 2019Updated 6 years ago
- Generation, analysis and visualization of reticular ornaments using Gavrog.☆39Dec 29, 2023Updated 2 years ago
- DeepChem 2017: Deep Learning & NLP for Computational Chemistry, Biology & Nano-materials☆23Jan 2, 2018Updated 8 years ago
- Automatically exported from code.google.com/p/semanticchemistry☆10Mar 7, 2021Updated 5 years ago
- Machine Learning and Neural Networks☆29May 22, 2023Updated 3 years ago
- Codes for text-mined solid-state reactions dataset☆95Oct 7, 2023Updated 2 years ago
- Managed Database hosting by DigitalOcean • AdPostgreSQL, MySQL, MongoDB, Kafka, Valkey, and OpenSearch available. Automatically scale up storage and focus on building your apps.
- Public release of data and code for materials synthesis generation☆76Aug 11, 2022Updated 3 years ago
- Making life easier using scripting languages (Bash and Python) to facilitate multiple VASP simulation jobs preparation, submission and an…☆13Dec 15, 2014Updated 11 years ago
- METAR reports are meteorogical weather reports for aviation. Metar is a small program which downloads weather reports for user-specified …☆13Sep 11, 2019Updated 6 years ago
- ☆18Aug 27, 2020Updated 5 years ago
- Optimizing Chemical Reactions with Deep Reinforcement Learning☆122Mar 3, 2021Updated 5 years ago
- Julia-based framework for battery modelling☆16Feb 18, 2025Updated last year
- This is the proof of concept, how a relatively unsophisticated statistical model trained on the large MPDS dataset predicts physical prop…☆11Oct 31, 2024Updated last year
- Extract ligands from original PDB file☆10Nov 1, 2019Updated 6 years ago
- Reaction Decoder Tool (RDT) - Atom Atom Mapping Tool☆84Apr 5, 2026Updated 3 months ago
- GPU virtual machines on DigitalOcean Gradient AI • AdGet to production fast with high-performance AMD and NVIDIA GPUs you can spin up in seconds. The definition of operational simplicity.
- A bridge between Pydantic V2 models and RDF graphs☆20May 3, 2025Updated last year
- a deep learning based drug target interaction prediction model☆11Nov 5, 2022Updated 3 years ago
- ☆35Jan 20, 2017Updated 9 years ago
- Reference implementation in python for Citrination api☆14Mar 18, 2026Updated 3 months ago
- Beyond Myopia: Learning from Positive and Unlabeled Data through Holistic Predictive Trends [NeurIPS 2023]☆10Jan 28, 2024Updated 2 years ago
- Official PyTorch implementation of "ProteinMAE: Masked Autoencoder for Protein Surface Self-supervised Learning".☆19May 7, 2024Updated 2 years ago
- ☆76Mar 19, 2021Updated 5 years ago