GitHub

ryp: R inside Python

running R code inside Python quickly transferring huge datasets between Python (NumPy/pandas/polars) and R without writing to disk interactively working in both languages at the same time ...
GitHub

FMOkit: A Python toolkit for the preparation and analysis of FMO calculations

FMOkit is a command-line toolkit written in Python for both preprocessing and postprocessing of Fragment Molecular Orbital(FMO) calculations. Generates GAMESS input files for FMO calculations from the ...
IEEE

Multimodal Data-Driven Prediction of PEMFC Performance and Process Conditions Using Deep Learning

Abstract: The proton-exchange membrane fuel cell (PEMFC) is one of the important technologies advancing sustainable energy. However, predicting its performance and optimizing processes is challenging ...
IEEE

High-Throughput Data Processing at FRIB Using ESnet

Abstract: Real-time or nearly real-time (nearline) data processing methods are critical tools as detector technologies and data acquisition (DAQ) systems allow for higher data rates and volumes. The ...