☆37Jul 18, 2025Updated last year
Alternatives and similar repositories for m2p
Users that are interested in m2p are comparing it to the libraries listed below. We may earn a commission when you buy through links labeled 'Ad' on this page.
Sorting:
- ☆18Jul 10, 2026Updated last month
- The repository for the generative pretrained model on polymer generation☆22Mar 20, 2026Updated 4 months ago
- Supplementary Data for "A graph representation of molecular ensembles for polymer property prediction"☆24Oct 12, 2022Updated 3 years ago
- Message Passing Neural Networks for Molecule Property Prediction☆51Oct 12, 2022Updated 3 years ago
- PSP is a python toolkit for predicting atomic-level structural models for a range of polymer geometries.☆50Jul 5, 2024Updated 2 years ago
- Wordpress hosting with auto-scaling - Free Trial Offer • AdFully Managed hosting for WordPress and WooCommerce businesses that need reliable, auto-scalable performance. Cloudways SafeUpdates now available.
- ☆30May 14, 2025Updated last year
- RadonPy is a Python library to automate physical property calculations for polymer informatics.☆273Updated this week
- The Block Copolymer Phase Behavior Database (BCDB)☆21Mar 1, 2024Updated 2 years ago
- Python interface for Enhanced Monte Carlo (EMC)☆24Jul 13, 2026Updated 3 weeks ago
- Hierarchical template correction for chemical reactions☆23Aug 9, 2024Updated 2 years ago
- polyVERSE is a comprehensive repository of informatics-ready datasets curated by the Ramprasad Group.☆40Jul 2, 2026Updated last month
- ☆26Feb 13, 2025Updated last year
- ☆12Mar 31, 2023Updated 3 years ago
- rule-based virtual polymer library generator☆54Dec 23, 2025Updated 7 months ago
- AI Agents on 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.
- A benchmark dataset for polymer informatics.☆103May 31, 2021Updated 5 years ago
- Augmenting Polymer Datasets via Iterative Rearrangement☆13Jun 30, 2023Updated 3 years ago
- A Python library for prediction of polymeric material properties.☆25May 6, 2022Updated 4 years ago
- An open-source effort towards accessible polymer data☆46Dec 26, 2020Updated 5 years ago
- Generate PEG topology for GROMACS and LAMMPS☆26Aug 19, 2024Updated last year
- ☆13May 13, 2022Updated 4 years ago
- Automated BigSMILES conversion workflow and dataset for homopolymeric macromolecules☆20Jun 9, 2024Updated 2 years ago
- Unified machine learning model for predicting polymer properties through human language instructions☆34May 6, 2025Updated last year
- CRIPT Python SDK☆11Apr 13, 2023Updated 3 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.
- ☆18Jan 11, 2024Updated 2 years ago
- Python wrapper for OSRA. Supports R-Group logic and integration with ChemSchematicResolver☆10Apr 4, 2020Updated 6 years ago
- Deep Supervised Graph Partitioning Model☆14Aug 3, 2021Updated 5 years ago
- Graph Learning over Macromolecule Representations☆25Dec 31, 2022Updated 3 years ago
- Shared repo for trajectory analysis and infrastructure development☆24Feb 21, 2024Updated 2 years ago
- Keras layers for end-to-end learning with rdkit and pymatgen☆62Jun 24, 2026Updated last month
- A Program for Molecular Structure and Topology Generation of Polymer-Grafted Hybrid Nanostructures☆12Jun 17, 2026Updated last month
- GitHub Repository for "Sigma Profiles in Deep Learning: Towards a Universal Molecular Descriptor"☆12Jul 25, 2024Updated 2 years ago
- Python code and jupyter notebooks to accompany the manuscript "Deep learning models for lipid-nanoparticle-based drug delivery"☆14Jul 28, 2020Updated 6 years ago
- Open source password manager - Proton Pass • AdSecurely store, share, and autofill your credentials with Proton Pass, the end-to-end encrypted password manager trusted by millions.
- Framework to evaluate UMLFFs on experimental data☆15Jul 25, 2026Updated 2 weeks ago
- python simulation interface for molecular modeling☆108Jun 26, 2022Updated 4 years ago
- NanoOpt: Deriving potentials for coarse-grained nanoparticles via potential-matching☆11Oct 8, 2021Updated 4 years ago
- ☆25Sep 3, 2024Updated last year
- A Molecular Stereostructure Descriptor based on Spherical Projection☆13Nov 14, 2025Updated 8 months ago
- Tools for polymer molecular dynamics simulations☆16Jul 20, 2026Updated 3 weeks ago
- Tool for the canonicalization of Polymer SMILES (P🙂) strings☆36Sep 3, 2024Updated last year