Pinned Repositories
F0AM
Framework for 0-D Atmospheric Modeling
kasal2010
mol2vec
Mol2vec - an unsupervised machine learning approach to learn vector representations of molecular substructures
openCOSMO-RS_conformer_pipeline
openCOSMO-RS_cpp
openCOSMO-RS_py
RGCxGC
An R package for preprocessing and Multivariate Analysis of Two-dimensional Gas Chromatography Data
simpleSOM_boxmodel
tgpipe
Pipeline for prediction of monomer glass transition temperature, and development of QSAR/QSPR models via mol2vec
UCR-ISOP
UCR-ISOP mechanism
kasal2010's Repositories
kasal2010/F0AM
Framework for 0-D Atmospheric Modeling
kasal2010/kasal2010
kasal2010/mol2vec
Mol2vec - an unsupervised machine learning approach to learn vector representations of molecular substructures
kasal2010/openCOSMO-RS_conformer_pipeline
kasal2010/openCOSMO-RS_cpp
kasal2010/openCOSMO-RS_py
kasal2010/RGCxGC
An R package for preprocessing and Multivariate Analysis of Two-dimensional Gas Chromatography Data
kasal2010/simpleSOM_boxmodel
kasal2010/tgpipe
Pipeline for prediction of monomer glass transition temperature, and development of QSAR/QSPR models via mol2vec
kasal2010/UCR-ISOP
UCR-ISOP mechanism
kasal2010/DSMACC
Dynamically Simple Model of Atmospheric Chemical Complexity
kasal2010/PTRwid
Collaborative copy of Rupert Holzingers TOF Spectrum Analyzer PTRwid
kasal2010/PyTRMS
Python bundle for proton-transfer reaction mass-spectrometry (PTR-MS).