Tarskin / HappyToolsLinks
A tool for the (high-throughput) processing of HPLC data.
☆36Updated 2 years ago
Alternatives and similar repositories for HappyTools
Users that are interested in HappyTools are comparing it to the libraries listed below
Sorting:
- Automated omics-scale protein modeling and simulation setup.☆53Updated 4 years ago
- Use UCSF Chimera Python API in a standard interpreter☆59Updated 6 years ago
- Pymol ScrIpt COllection (PSICO)☆62Updated 2 months ago
- A python library for prediction of drug metabolites☆17Updated 7 years ago
- Control PyMOL sessions via IPython☆61Updated 2 years ago
- ☆33Updated 10 months ago
- Modeling and Bayesian analysis of fluorescence and absorbance assays.☆19Updated 4 years ago
- A high level cheminformatics package for the Scientific Python stack, built on RDKit.☆65Updated 5 years ago
- The python implementation of the MMTF API, decoder and encoder.☆46Updated 3 years ago
- RDKit wrapper☆49Updated last year
- This repository contains training data for retention time prediction for the identification of metabolites from non-targeted LC-MS based …☆55Updated 2 weeks ago
- CheTo - Chemical Topic Modeling☆32Updated 4 years ago
- Open Source Protein REdesign for You v3☆54Updated 3 months ago
- The Integrative Modeling Platform☆77Updated last week
- Conda build recipe for the rdkit☆51Updated 3 years ago
- ChemMine Tools: open source web framework for small molecule analysis☆39Updated 2 years ago
- Universal Deconvolution of Mass and Ion Mobility Spectra☆78Updated 2 weeks ago
- A novel approach to pose selection in protein-ligand docking based on graph theory.☆20Updated 8 years ago
- Web Interface for ChEMBL @ EMBL-EBI☆52Updated 3 years ago
- In silico chemical library engine for high-accuracy chemical property prediction☆62Updated 5 months ago
- Reaction Decoder Tool (RDT) - Atom Atom Mapping Tool☆78Updated 3 years ago
- ☆31Updated 5 months ago
- Interactive Python notebooks for PDBe API training☆57Updated last month
- Automated analysis of LCMS data for high throughput chemistry experiments☆22Updated 2 weeks ago
- A collection of useful tutorials for Protein Science☆108Updated 10 years ago
- analyse PDB files, run molecular-dynamics & analyse trajectories☆61Updated 7 years ago
- A Python library for structural cheminformatics☆103Updated 6 months ago
- Challenge inputs, details, and results for the SAMPL6 series of challenges☆54Updated 3 years ago
- HDXer is a package to compute Hydrogen-Deuterium exchange data from biomolecular simulations, compare to experiment, and perform ensemble…☆19Updated 2 years ago
- Containerised components for cheminformatics and computational chemistry☆36Updated 2 years ago