REU_report.pdf (2.7 MB)
Download fileTechnical Report: SPIDAL Summer REU 2021 Upgrading MDPOW and Adding Analysis Functionality
MDPOW is an open source Python library for calculating water-octanol and water-cyclohexane partition coefficients. During the REU MDPOW was upgraded to support Python 3. Additionally a collection of an analysis submodule was developed simplifying the process of studying simulations.