Lawrence Livermore National Laboratory
7000 East Avenue • Livermore, CA 94550
Operated by Lawrence Livermore National Security, LLC, for the
Department of Energy's National Nuclear Security Administration.
PairScore is a preliminary code to predict binding affinity from the pairwise distances between protein and ligand atoms. The repo contains an example.
Lawrence Livermore National Laboratory
7000 East Avenue • Livermore, CA 94550
Operated by Lawrence Livermore National Security, LLC, for the
Department of Energy's National Nuclear Security Administration.