ajaymur91 / CLIPS

Fast estimation of ion-pairing for screening electrolytes

ajaymur91/CLIPS Issues

Support for automatic detection of reference atoms (for distance calculations)
Closed a year ago
Include support for other ions/solvent
Closed a year ago
GPU support
Closed a year ago1
Optimize Upper wall bias for stability of results
Closed 3 years ago1
Automate detection of solvent number
Closed 3 years ago1