ianreah / Molecules3D
3D chemical structure visualisation with three.js
☆18Updated last year
Alternatives and similar repositories for Molecules3D:
Users that are interested in Molecules3D are comparing it to the libraries listed below
- Notebook-integrated tools for molecular simulation and visualization☆166Updated 6 years ago
- Molecular Dynamics in the Open☆74Updated 3 weeks ago
- 2D/3D generation for small compounds☆32Updated 5 years ago
- MolCalc is a web interface that allows anyone to build molecules and calculate molecular properties online☆86Updated 2 years ago
- An embeddable webGL molecule viewer and file format converter.☆85Updated 3 years ago
- Mapping from Coarse Grain Models to Atomistic (and Back)☆15Updated last year
- 2D and 3D molecular visualization in Jupyter notebooks using 3DMol.js and D3.js☆77Updated 6 years ago
- A molecular viewer written in Javascript and WebGL☆76Updated 5 years ago
- Suite of programs to perform non-linear dimensionality reduction -- sketch-map in particular☆46Updated 4 months ago
- Flexible storage of chemical topology for molecular simulation☆54Updated last week
- ☆18Updated 4 years ago
- ☆18Updated last month
- The Molecular Modelling Toolkit☆50Updated 2 years ago
- WebGL molecule viewer made with Babylon.js☆33Updated 9 years ago
- Chemical perception tree automated exploration tool.☆19Updated 6 years ago
- Tinker9: Next Generation of Tinker with GPU Support☆50Updated last year
- MDAnalysis home page mdanalysis.org as GitHub pages.☆14Updated last week
- Quantum Mechanical Bespoke Force Field Derivation Toolkit☆95Updated 7 months ago
- ☆51Updated 7 years ago
- OpenMM testbed for constant-pH methodologies.☆20Updated 3 years ago
- Mirror of https://github.com/lukasturcani/stk - please file issues / fork / star that repo.☆21Updated 2 years ago
- Automated Monte Carlo Conformational Searching with Python☆17Updated 4 years ago
- Tools for ThermoML parsing☆20Updated 3 years ago
- Using neural networks for enhanced sampling in computational biophysics☆16Updated 7 years ago
- MD trajectory server☆34Updated last year
- A framework for conducting polymer reference interaction site model (PRISM) calculations☆42Updated 3 years ago
- psi4+RDKit☆98Updated 2 years ago
- MolSSI SARS-CoV-2 Biomolecular Simulation Data and Algorithm Store☆29Updated last year
- 2D molecule visualization component☆21Updated 8 years ago
- Using supervised machine learning to build collective variables for accelerated sampling☆28Updated 6 years ago