abrechts / Phoenix-ELNLinks
Electronic lab notebook for organic chemistry
☆12Updated 2 weeks ago
Alternatives and similar repositories for Phoenix-ELN
Users that are interested in Phoenix-ELN are comparing it to the libraries listed below
Sorting:
- PHP/MySQL-based chemical inventory/Electronic Lab Notebook for chemistry☆13Updated last year
- Extraction and re-use(ability) of chemical information from common scientific documents containing ChemDraw files☆21Updated 4 years ago
- ☆19Updated 6 years ago
- A curated list of tools and servers for computer-aided drug design and discovery.☆27Updated last month
- ☆8Updated 2 years ago
- The purpose of this repo is to allow continued development of the Extensible Computational Chemistry Environment (ECCE) which used to be …☆9Updated 6 years ago
- ☆19Updated 2 weeks ago
- Visualizing the space of chemical reactions with the parametric (learnable) t-SNE.☆15Updated 3 years ago
- An editor to View and Edit Chemical Spectra data (NMR, IR and MS).☆13Updated last month
- CheMeleon Descriptor-based Foundation Model☆65Updated this week
- A chemical Organic Synthesis Exploration Tool☆11Updated 6 years ago
- Histidine Protonation State Optimizer for setting up MD simulations based on semi-empirical QM resonance☆16Updated last month
- Main InChI repository☆91Updated last week
- This is the current development version of a quantum classical package for calculating coherent multidimensional spectra (as FTIR, SFG, 2…☆13Updated last month
- Common molecule fragments for visualization in Avogadro☆17Updated 5 months ago
- Code for training machine learning model for reaction condition prediction☆42Updated 5 years ago
- QSARtuna: QSAR model building with the optuna framework☆130Updated 8 months ago
- Generalized 2D Correlation Spectroscopy by Python☆22Updated 3 years ago
- Read Nicolet/Thermo Omnic files on python (.spa).☆13Updated last year
- A Knowledge Graph of Common Chemical Names to their Molecular Definition☆165Updated 5 months ago
- ☆77Updated last year
- Structure-based fragment identification in latent space☆16Updated last month
- ChemicalTagger is a tool for semantic text-mining in chemistry.☆43Updated 9 months ago
- This set of essential and valuable microservices is designed to be accessed via API calls to support cheminformatics.☆47Updated last week
- Benchmarking human and machine learning performance.☆34Updated 5 years ago
- Fast Molecular Property Prediction with mordredcommunity☆43Updated last month
- Interactive data analysis and visualisation with chemical intelligence☆118Updated last week
- Code for generation and benchmarks of the Multimodal Spectroscopic Dataset☆42Updated 3 weeks ago
- The backend services of the GenUI framework. The backend provides the REST API used for molecular generation, QSAR modelling and chemical…☆33Updated 4 months ago
- Plug-in for ChimeraX providing features for building and manipulating organic and organometallic molecules as well as displaying output f…☆28Updated last month