mefortunato

Computational chemist & data scientist

Pinned Repositories

ASKCOS
Language:Python00
chemprop
Message Passing Neural Networks for Molecule Property Prediction
Language:Python00
exabyte-rewotes
Language:Python00
fftyper-flask
Language:HTML00
mdChromeApp
Language:JavaScript00
nbastats
Language:HTML10
nbastats-flask
BetSmart web app. Get informed using data driven betting behavior.
Language:HTML10
pysimm
python simulation interface for molecular modeling
Language:Python01
tdi-project
12-day project for The Data Incubator
Language:HTML00
tdi-project-react
12-day project for The Data Incubator made with React
Language:JavaScript00

mefortunato's Repositories

mefortunato/nbastats
Language:HTML10
mefortunato/nbastats-flask
BetSmart web app. Get informed using data driven betting behavior.
Language:HTML10
mefortunato/ASKCOS
Language:Python00
mefortunato/chemprop
Message Passing Neural Networks for Molecule Property Prediction
Language:Python00
mefortunato/exabyte-rewotes
Language:Python00
mefortunato/fftyper-flask
Language:HTML00
mefortunato/mdChromeApp
Language:JavaScript00
mefortunato/polymer-tg-workflow
Language:Python01
mefortunato/pysimm
python simulation interface for molecular modeling
Language:Python01
mefortunato/tdi-project
12-day project for The Data Incubator
Language:HTML00
mefortunato/tdi-project-react
12-day project for The Data Incubator made with React
Language:JavaScript00
mefortunato/rdchiral
Wrapper for RDKit's RunReactants to improve stereochemistry handling