A chemical model of planetary atmospheres
An astrochemical network parser that supports multiple reaction network formats including KIDA, UDFA, PRIZMO, KROME, and UCLCHEM.
Web application to explore the QUEST database
Combining SchNet, PaiNN and SHARC – Bridging the Gap between Machine Learning and Photoinduced Dynamics
This app is for fitting Time Resolved Photoluminescence (TRPL) measurement data that includes the Instrument Response Function (IRF). It uses a reconvolution method to account for the IRF of the instrument system. It outputs fitting parameters and offers multiple lifetime decay models.
Computational Data for the study of the photoisomerization mechanism of PAT
AI-powered botanical analysis tool using LangGraph and local Ollama (Llama3) for real-time phytochemical tracking and clinical report generation.
Automated application of Woodward-Fieser, Fieser and Fieser-Kuhn rules to predict absorption maxima of organic chromophores.
CDFD Part II: Origins of Life and Tri-Regime Bioenergetics
The Horiba Duetta fluorescence and absorbance spectrometer outputs data as .txt, which is not useful to anyone trying to do anything with this data. This program will convert the .txt file to .csv for analysis.
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