Name | Version | Summary | date |
periodic2023 |
2.2.1 |
A periodic table API. |
2023-01-25 12:33:26 |
wikidataintegrator |
0.9.27 |
Python package for reading and writing to/from Wikidata |
2023-01-19 21:53:58 |
moffragmentor |
0.0.6 |
Splits MOFs into metal nodes and linkers. |
2022-12-24 08:40:35 |
element-coder |
0.0.8 |
Encode chemical elements numerically and decode numerical representations of elements. |
2022-12-19 08:15:48 |
pyvaporation |
1.2.0 |
Set of tools for modelling pervaporation processes |
2022-12-06 11:33:26 |
summit |
0.8.8 |
Tools for optimizing chemical processes |
2022-12-02 19:48:22 |
palmiche |
0.0.0a4 |
A python package for automation of MD simulations |
2022-12-01 12:36:37 |
global-chem-extensions |
1.0.3 |
|
2022-09-03 14:35:44 |
Auto-FOX |
0.10.2 |
A library for analyzing potential energy surfaces (PESs) and using the resulting PES descriptors for constructing forcefield parameters. |
2022-08-31 15:32:15 |
PubChemPy |
1.0.4 |
A simple Python wrapper around the PubChem PUG REST API. |
2017-04-11 18:36:23 |
ChemDataExtractor |
1.3.0 |
A toolkit for extracting chemical information from the scientific literature. |
2017-02-03 00:12:05 |
CIRpy |
1.0.2 |
Python wrapper for the NCI Chemical Identifier Resolver (CIR). |
2016-01-04 23:46:47 |