SimonEnsemble
Associate Professor of Chemical Engineering, Oregon State University
Oregon State UniversityCorvallis, Oregon
Pinned Repositories
Controlz.jl
simulation of simple controls problems in Julia
data_science_course
CHE 599 at Oregon State University
graph-kernel-SVM-for-toxicity-of-pesticides-to-bees
reproduce our bee toxicity paper DOI: 10.1063/5.0090573
IAST.jl
ideal adsorbed solution theory (IAST)
mpn_charges
predicting charges on MOF atoms via a message passing MOFs
PoreMatMod.jl
a find-and-replace tool for crystal structure models. implements (i) subgraph matching and (ii) point set alignment to search a parent crystal for a query fragment, then align and install a replacement fragment in its place.
porous-material-AI-gym
open data sets for machine learning pertaining to porous materials
PorousMaterials.jl
Julia package towards classical molecular modeling of nanoporous materials
RxnDfn
numerical solution to 1D reaction diffusion equations
Xtals.jl
working with crystal structures
SimonEnsemble's Repositories
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