Pinned Repositories
PSI4Helper
blog
Shared iPython Notebooks
marpat.github.io
NboScan
Java GUI app to process Gaussian PES files
pes_nbo
Python script with core capabilities of the NboScan Java GUI app
nbo-processing
Scripts to process NBO txt files
brp
Jupyter notebooks created by Bright Rock Path consulting
marpat's Repositories
marpat/marpat.github.io
marpat/blog
Shared iPython Notebooks
marpat/brp
Jupyter notebooks created by Bright Rock Path consulting
marpat/PSI4Helper
marpat/photoweb
phototech website update
marpat/pandas_snippets
marpat/NboScan
Java GUI app to process Gaussian PES files
marpat/nbo-processing
Scripts to process NBO txt files
marpat/pes_nbo
Python script with core capabilities of the NboScan Java GUI app