add-on to plotly which show molecule images on mouseover!
☆263Mar 17, 2026Updated 2 months ago
Alternatives and similar repositories for molplotly
Users that are interested in molplotly are comparing it to the libraries listed below. We may earn a commission when you buy through links labeled 'Ad' on this page.
Sorting:
- Interactive molecule viewer for 2D structures☆254Dec 27, 2025Updated 4 months ago
- Explainer for black box models that predict molecule properties☆351Apr 1, 2026Updated last month
- Yet another ML method comparison☆16Nov 20, 2022Updated 3 years ago
- Some useful RDKit functions☆228Apr 30, 2026Updated 2 weeks ago
- Molecular Processing Made Easy.☆534Jun 10, 2024Updated last year
- 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.
- A python package for chemical space visualization.☆152Apr 6, 2026Updated last month
- Extracting medicinal chemistry intuition via preference machine learning☆119Oct 31, 2023Updated 2 years ago
- Scoring of shape and ESP similarity with RDKit☆235Aug 19, 2025Updated 9 months ago
- A Python package for calculating molecular features☆225Updated this week
- ChEMBL database structure pipelines☆240Nov 24, 2025Updated 5 months ago
- Auto3D generates low-energy conformers from SMILES/SDF☆192Jan 22, 2026Updated 3 months ago
- The MinHashed Atom Pair fingerprint of radius 2☆123May 1, 2023Updated 3 years ago
- CReM: chemically reasonable mutations framework☆267Mar 17, 2026Updated 2 months ago
- Robust representation of semantically constrained graphs, in particular for molecules in chemistry☆843May 17, 2025Updated last year
- Deploy on Railway without the complexity - Free Credits Offer • AdConnect your repo and Railway handles the rest with instant previews. Quickly provision container image services, databases, and storage volumes.
- Simple package for fast molecular similarity searches☆169Mar 11, 2026Updated 2 months ago
- A package to identify matched molecular pairs and use them to predict property changes.☆285Jan 25, 2026Updated 3 months ago
- Synthesis generative model☆47Apr 24, 2025Updated last year
- cime public repository☆32Jan 12, 2023Updated 3 years ago
- ☆38Aug 11, 2023Updated 2 years ago
- Practical Cheminformatics Tutorials☆1,245May 2, 2026Updated 2 weeks ago
- A curated list of Cheminformatics libraries and software.☆864Mar 15, 2024Updated 2 years ago
- 🧪📈 🐍. The purpose of the panel-chemistry project is to make it really easy for you to do DATA ANALYSIS and build powerful DATA AND VI…☆126Nov 25, 2023Updated 2 years ago
- ChemCharts is a module that allows you to plot chemical space in various figure types☆16Sep 24, 2023Updated 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.
- Simple Python interface to OPSIN: Open Parser for Systematic IUPAC nomenclature☆76Mar 16, 2026Updated 2 months ago
- Descriptor computation(chemistry) and (optional) storage for machine learning☆279Oct 26, 2024Updated last year
- An Open-Source Molecular Builder and Free Energy Preparation Workflow☆142Nov 10, 2025Updated 6 months ago
- fast functionalisation of molecules☆39Nov 8, 2021Updated 4 years ago
- ☆99Aug 23, 2024Updated last year
- scikit-learn classes for molecular vectorization using RDKit☆201Nov 2, 2025Updated 6 months ago
- Matcher is a tool for understanding how chemical structure optimization problems have been solved. Matcher enables deep control over sear…☆68Feb 21, 2024Updated 2 years ago
- ☆54Jan 17, 2026Updated 4 months ago
- Computer-aided synthesis planning☆51Updated this week
- 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.
- Materials from the (virtual) 2020 RDKit UGM☆52Oct 26, 2020Updated 5 years ago
- An automated scoring function to facilitate and standardize the evaluation of goal-directed generative models for de novo molecular desig…☆235Apr 21, 2026Updated 3 weeks ago
- TeachOpenCADD: a teaching platform for computer-aided drug design (CADD) using open source packages and data☆1,002May 12, 2026Updated last week
- psi4+RDKit☆107May 13, 2025Updated last year
- Merging, linking and placing compounds by stitching bound compounds together like a reanimated corpse☆206May 12, 2026Updated last week
- Converts clipboard content to smiles and much more☆65Jun 6, 2024Updated last year
- Materials from the (virtual) 2021 RDKit UGM☆38Oct 22, 2021Updated 4 years ago