croningp / pylabwareLinks
A Python 3 class for communication with serial devices such as hotplate stirrers, vacuum pumps etc.
☆12Updated 4 years ago
Alternatives and similar repositories for pylabware
Users that are interested in pylabware are comparing it to the libraries listed below
Sorting:
- A Python tool for local chemical space exploration of any structure based on their 3D geometry☆13Updated last year
- A graph database tool for experimental data in materials science and chemistry.☆19Updated 9 months ago
- Curated list of known efforts in collecting and/or curating of chemical/materials data☆21Updated 4 years ago
- The goal of the UDM project is to create and publish an open, extendable and freely available data format for exchange of experimental i…☆19Updated 4 years ago
- Implementation of various machine learning representations for molecules☆25Updated 3 years ago
- Automated Transition States Builder☆11Updated 2 years ago
- References, presentations and other resources☆15Updated last year
- A molecular identifier and descriptor for all domains of chemistry.☆24Updated 9 months ago
- Data for Coordination Complexes for the InChI Identifier☆12Updated 4 years ago
- ☆11Updated 3 weeks ago
- Augmenting Polymer Datasets via Iterative Rearrangement☆12Updated 2 years ago
- fast functionalisation of molecules☆37Updated 3 years ago
- SECS is a machine learning framework designed for structure elucidation from spectra such as NMR and IR.☆20Updated 2 weeks ago
- autoDIAS: a python tool for an automated Distortion/Interaction Activation Strain Analysis☆18Updated 4 years ago
- Python-based library for working with computational chemistry files☆21Updated 6 months ago
- Flowchem is an application to simplify the control of instruments and devices commonly found in chemistry labs.☆18Updated 2 weeks ago
- Given an RDKit molecule that does not sanitise, correct it until it does☆41Updated last year
- Computational Chemistry☆24Updated 3 months ago
- Golem: an algorithm for robust experiment and process optimization☆18Updated 4 years ago
- ☆21Updated last week
- Python script to lookup pKa values☆26Updated last month
- Template-directed automatic generation of transition state structures.☆11Updated 8 years ago
- ☆16Updated last year
- ☆20Updated 2 years ago
- ☆11Updated last year
- Program package for the quantum mechanical calculation of EI mass spectra using automated reaction network exploration☆21Updated last month
- A framework for using topological data analysis to extract structure/symmetry from scientific systems.☆25Updated 3 years ago
- An overview over chemical datasets and where to find them☆17Updated 2 years ago
- PolyMetriX is a comprehensive Python library that powers the entire machine learning workflow for polymer informatics.☆20Updated 2 weeks ago
- Quick Reaction Coordinate using Python☆39Updated last year