Pinned Repositories
CohortProject_2020
Open collaboration of the Quantum Bootcamp 2020
EDS_quantification
mlp-train
MLP training for molecular systems
NAST
Nonadiabatic statistical theory package for predicting kinetics of spin-dependent processes
p-VQD
This repository include the source code for the p-VQD algorithm for quantum simulation.
Phys_105B
pymctdh
python code to perform Multiconfigurational Time-Dependent Hartree calculations
rmsd
Calculate Root-mean-square deviation (RMSD) of two molecules, using rotation, in xyz or pdb format
ishume94's Repositories
ishume94/mlp-train
MLP training for molecular systems
ishume94/Phys_105B
ishume94/EDS_quantification
ishume94/rmsd
Calculate Root-mean-square deviation (RMSD) of two molecules, using rotation, in xyz or pdb format
ishume94/pymctdh
python code to perform Multiconfigurational Time-Dependent Hartree calculations
ishume94/NAST
Nonadiabatic statistical theory package for predicting kinetics of spin-dependent processes
ishume94/p-VQD
This repository include the source code for the p-VQD algorithm for quantum simulation.
ishume94/CohortProject_2020
Open collaboration of the Quantum Bootcamp 2020