We read every piece of feedback, and take your input very seriously.
To see all available qualifiers, see our documentation.
Prevent this user from interacting with your repositories and sending you notifications. Learn more about blocking users.
You must be logged in to block users.
Contact GitHub support about this user’s behavior. Learn more about reporting abuse.
helPME: an efficient library for particle mesh Ewald
C++ 31 16
OpenMM plugin that implements (an)isotropic polarizable point dipoles and multipoles up to octopoles.
C++ 11 7
Molecule drawing program
C++ 2
Forked from psi4/psi4
Open-Source Quantum Chemistry – an electronic structure package in C++ driven by Python
C++ 1
Forked from filippolipparini/ddPCM
A fast domain decomposition based implementation of the COSMO solvation model
Fortran 1
Pilot implementations of the SGT algorithm for electrostatics
C++ 1 2
There was an error while loading. Please reload this page.