22 skills found
epam / IndigoUniversal cheminformatics toolkit, utilities and database search tools
IUPAC-InChI / InChIMain InChI repository
sebotic / Cdk PywrapperA Python wrapper for the Chemistry Development Kit (CDK)
bafgreat / MofstructureA python package to deconstruct MOFs into building units, compute porosity, remove unbound guests and compute cheminfomatic data of building units
longemen3000 / ChemicalIdentifiers.jlchemical identifiers (CAS, PubChemID, SMILES,InChI, InChI keys, names) from text search
metamolecular / Inchi JsInChI for the Browser
aclarkxyz / Data CoordinchiData for Coordination Complexes for the InChI Identifier
bioclipse / Bioclipse.cheminformaticsBioclipse Cheminformatics Feature
dan2097 / Jna InchiWrapper to access InChI from Java
smikes / InchiInChI for node.js
yhy-2000 / CLIP InChineseNo description available
boecker-lab / StandardizeUtilsA Python package for standardizing SMILES and InChI strings with RDKit and PubChem
metamolecular / InchiInChI source as received from IUPAC
IUPAC-InChI / InChI Web DemoThe InChI-Web-Demo repository contains the code for the evaluation of InChIs out of chemical depictions in any browser for training and test purposes.
rapodaca / Inchi WasmCompiles InChI C source to WebAssembly.
chobeat / InchiestaInchiesta sul lavoro informatico
NIVANorge / ChemspiderapiR functionalites for ChemSpider's new API services
jhmlam / InchingNo description available
inchiresolver / InchiresolverRepository of the InChI Resolver project - linking InChI related data and resources on the Internet
johnmay / Inchi MaInChI Metal Architecture Proof of Concept
