The Block Copolymer Phase Behavior Database (BCDB)
☆20Mar 1, 2024Updated 2 years ago
Alternatives and similar repositories for BCDB
Users that are interested in BCDB are comparing it to the libraries listed below. We may earn a commission when you buy through links labeled 'Ad' on this page.
Sorting:
- Quantifying Pairwise Chemical Similarity for Polymers☆15Jan 23, 2024Updated 2 years ago
- Generator of SMILES string from bigSMILES with extension☆35May 15, 2025Updated 10 months ago
- ☆12Dec 2, 2022Updated 3 years ago
- A benchmark dataset for polymer informatics.☆91May 31, 2021Updated 4 years ago
- Code for the paper Copolymer Informatics with Multi-Task Deep Neural Networks☆14Sep 3, 2024Updated last year
- 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.
- ☆35Jul 18, 2025Updated 8 months ago
- AI-Guided Inverse Design and Discovery of Recyclable Vitrimeric Polymers: https://doi.org/10.1002/advs.202411385☆12Oct 18, 2025Updated 5 months ago
- Automatic Martini force field generator for small organic molecules (up to 25 heavy atoms), Martini 3 compatible☆36Mar 23, 2026Updated 2 weeks ago
- Deep Supervised Graph Partitioning Model☆14Aug 3, 2021Updated 4 years ago
- Code for "Inverse Design of Copolymers Including Stoichiometry and Chain Architecture"☆13Nov 19, 2025Updated 4 months ago
- rule-based virtual polymer library generator☆50Dec 23, 2025Updated 3 months ago
- Unified machine learning model for predicting polymer properties through human language instructions☆28May 6, 2025Updated 11 months ago
- ☆14Apr 15, 2024Updated last year
- Polymer Self-Consistent Field Theory (C++/CUDA version)☆41Updated this week
- 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.
- ☆20Feb 16, 2024Updated 2 years ago
- polyVERSE is a comprehensive repository of informatics-ready datasets curated by the Ramprasad Group.☆32Jan 21, 2026Updated 2 months ago
- PolyMetriX is a comprehensive Python library that powers the entire machine learning workflow for polymer informatics.☆40Nov 17, 2025Updated 4 months ago
- Python wrapper for OSRA. Supports R-Group logic and integration with ChemSchematicResolver☆10Apr 4, 2020Updated 6 years ago
- An open-source effort towards accessible polymer data☆43Dec 26, 2020Updated 5 years ago
- The repository for the generative pretrained model on polymer generation☆18Mar 20, 2026Updated 3 weeks ago
- 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
- A package for deriving coarse-grain potentials using MultiState Iterative Boltzmann Inversion (MS-IBI)☆18Mar 20, 2026Updated 3 weeks ago
- Supplementary Data for "A graph representation of molecular ensembles for polymer property prediction"☆23Oct 12, 2022Updated 3 years 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.
- CRIPT Python SDK☆11May 29, 2024Updated last year
- Large language models, physics-based modeling, experimental measurements: the trinity of data-scarce learning of polymer properties☆14Sep 4, 2025Updated 7 months ago
- An interactive structure viewer alongside its simulated diffraction pattern☆19Mar 16, 2026Updated 3 weeks ago
- Generate input parameters and coordinates for atomistic and coarse-grained simulations of polymers, ssDNA, and carbohydrates☆187Apr 1, 2026Updated last week
- Python code and jupyter notebooks to accompany the manuscript "Deep learning models for lipid-nanoparticle-based drug delivery"☆14Jul 28, 2020Updated 5 years ago
- More efficient and faster version of pyscal☆29Mar 2, 2026Updated last month
- NanoOpt: Deriving potentials for coarse-grained nanoparticles via potential-matching☆11Oct 8, 2021Updated 4 years ago
- Source code for "Improving Chemical Reaction Yield Prediction Using Pre-Trained Graph Neural Networks"☆21Oct 31, 2024Updated last year
- A Molecular Stereostructure Descriptor based on Spherical Projection☆13Nov 14, 2025Updated 4 months 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.
- A bash script that turns a version-controlled paper into a cool timelapse.☆14Mar 21, 2013Updated 13 years ago
- ☆17Apr 9, 2024Updated 2 years ago
- Learning free energy landscapes using artificial neural networks☆14Nov 30, 2017Updated 8 years ago
- ☆22Feb 13, 2025Updated last year
- Benchmark CPUs and GPUs by running molecular dynamics simulations in LAMMPS☆15Oct 25, 2022Updated 3 years ago
- Geometric super-resolution for molecular geometries☆42Jun 15, 2022Updated 3 years ago
- A set of tutorials to introduce new users to mBuild☆11Jun 14, 2021Updated 4 years ago