ChemEx is an analysis program for chemical exchange detected by NMR.
☆38Oct 23, 2026Updated last week
Alternatives and similar repositories for ChemEx
Users that are interested in ChemEx are comparing it to the libraries listed below. We may earn a commission when you buy through links labeled 'Ad' on this page.
Sorting:
- A simple library for handling NMR data in Julia☆15Oct 21, 2026Updated last week
- A module for working with NMR data in Python☆277Oct 8, 2026Updated 3 weeks ago
- Graphical simulation of NMR Bloch equations written in Python☆57Nov 7, 2025Updated 11 months ago
- A Python module for reading, writing, and manipulating NMR-STAR files.☆30Oct 22, 2026Updated last week
- Command-line tools for protein structure analysis: convert PDB, mmCIF, PDBML, or XYZR files into atomic sphere data, then compute volumes…☆16Jul 25, 2026Updated 3 months 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.
- Software for the prediction of DEER and PRE data from conformational ensembles.☆14May 6, 2025Updated last year
- ☆18Aug 28, 2025Updated last year
- AlphaFold version that is extended to integrate diversity parameters for massive sampling.☆18May 4, 2026Updated 5 months ago
- Emap2sec+: Detecting Protein and DNA/RNA Structures in Cryo-EM Maps of Intermediate Resolution Using Deep Learning☆19Nov 21, 2025Updated 11 months ago
- Library for processing of chemistry related files (aiming at spectroscopy and structural files)☆18Jun 13, 2024Updated 2 years ago
- Basis sets, estimators and solvers for the variational approach of conformation dynamics. NOTE: the code has been merged with PyEMMA and …☆10Dec 8, 2016Updated 9 years ago
- Rigid body fitting of atomic strucures in cryo-electron microscopy density maps☆24Updated this week
- NMR Chemical Shifts from Molecular Dynamics Simulation☆15Sep 17, 2021Updated 5 years ago
- BMRB API server and client implementations.☆11Oct 8, 2026Updated 3 weeks 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.
- Some notes (cookbook) for pyMol. Protein Crystallography course.☆17Jun 19, 2021Updated 5 years ago
- ☆13Apr 12, 2018Updated 8 years ago
- SHApe simulation with graph KERnels☆10May 17, 2021Updated 5 years ago
- Analysis pipeline for RNA structural probing mutational profiling data sequenced on Nanopore devices☆12Feb 10, 2024Updated 2 years ago
- TomoNet is a GUI based pipeline package focusing on cryoET and STA data processing☆23Mar 12, 2026Updated 7 months ago
- GAMMA C++ and PyGAMMA wrapped code packages☆12Sep 8, 2025Updated last year
- Read NMR data files for proteins and generate GROMACS input files☆10Apr 20, 2024Updated 2 years ago
- ☆15Sep 30, 2026Updated last month
- Deconvolution of RNA Alternative COnformations☆16Jun 24, 2026Updated 4 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 deconvolution pipeline designed to enhance the quality of 3D cryo-EM maps that suffer from anisotropic resolutions.☆14Apr 21, 2026Updated 6 months ago
- Numerical inversion package for time-domain Nuclear Magnetic Resonance (NMR) relaxation and diffusion experiments. Click on the link bel…☆14Oct 16, 2026Updated 2 weeks ago
- A fork of Autodock Vina for DeltaVina scoring function☆10Nov 7, 2016Updated 9 years ago
- Mirror of https://codeberg.org/rvhonorato/gdock >> development happens on Codeberg☆20Jul 7, 2026Updated 3 months ago
- Analysis of contacts in molecular dynamics trajectories☆48Nov 4, 2019Updated 6 years ago
- Mechanical Turk on your own machine for chemical literature annotation☆13Feb 17, 2022Updated 4 years ago
- [ICML 2025] Repurposing pre-trained score-based generative models for transition path sampling by minimizing the Onsager-Machlup (OM) act…☆30Mar 20, 2026Updated 7 months ago
- ⛓️ Boltz with restraint-guided inference☆22Sep 28, 2026Updated last month
- Bloch-McConnell simulation (full numerical)☆16Sep 19, 2022Updated 4 years ago
- Proton VPN Special Offer - Get 70% off • AdSpecial partner offer. Trusted by over 100 million users worldwide. Tested, Approved and Recommended by Experts.
- Python script that receives a molecular dynamics or Monte Carlo trajectory and performs agglomerative clustering to classify similar stru…☆30Sep 28, 2026Updated last month
- MDPath - A tool for calculating allosteric communication pathways in proteins by analyzing the mutual information of residue dihedral ang…☆32Oct 5, 2026Updated 3 weeks ago
- A program for the analysis of NMR data.☆31Jun 23, 2024Updated 2 years ago
- React component to display and process nuclear magnetic resonance (NMR) spectra.☆83Updated this week
- nmrML is an open mark-up language for NMR data. This is the official repository for development of the nmrML schema and NMR ontology.☆33Mar 27, 2025Updated last year
- VMD Tcl language scripts of molecular dynamics modeling, analyzing, and visualization.☆11Apr 12, 2020Updated 6 years ago
- Neural networks to analyze structural heterogeneity in cryo-electron sub-tomograms☆33Oct 23, 2026Updated last week