Speed up grompp LJ parameter generation
authorBerk Hess <hess@kth.se>
Fri, 18 Jun 2021 13:12:44 +0000 (13:12 +0000)
committerPaul Bauer <paul.bauer.q@gmail.com>
Fri, 18 Jun 2021 13:12:44 +0000 (13:12 +0000)
commit5acd6fa89f8503f529088e0c714364f7ee7164b9
treebaca340d27514abda3e7664ac70bfe798ba86468
parent7659484343576143ed031e8259e045f5718d3777
Speed up grompp LJ parameter generation
src/gromacs/gmxpreprocess/toppush.cpp