deltaVis

Protein partial charge visualization. Powered by CUDA.

Get up and running with deltaVis

generate atomic positions and partial charges from

source getProtein.sh <PDB ID>
make application

make
enjoy! (instructions for interaction included in terminal)

./main.exe

***Not currently robust to protein inputs, without manual fixes

Name		Name	Last commit message	Last commit date
Latest commit History 2 Commits
.gitignore		.gitignore
Makefile		Makefile
README.md		README.md
aminoacids.txt		aminoacids.txt
device_funcs.cu		device_funcs.cu
device_funcs.cuh		device_funcs.cuh
getProtein.sh		getProtein.sh
interactions.h		interactions.h
kernel.cu		kernel.cu
kernel.h		kernel.h
main.cpp		main.cpp