Clang-format.
authorSebastian Kehl <sebastian.kehl@mpcdf.mpg.de>
Mon, 27 Sep 2021 06:44:10 +0000 (08:44 +0200)
committerMagnus Lundborg <magnus.lundborg@scilifelab.se>
Tue, 5 Oct 2021 11:38:46 +0000 (11:38 +0000)
src/gromacs/gmxlib/nonbonded/nb_softcore.h

index 312597f97b1ca36007aab8385de1d3e870fa4408..f06c48b3fc7a68775ec192aa96ba45b6055b83a1 100644 (file)
@@ -251,8 +251,8 @@ static inline void lennardJonesQuadraticPotential(const RealType c6,
                                    + (6.5_real * rInv12C - rInv6C));
 
             potentialQuad = potentialQuad
-                             + gmx::selectByMask(((c12s * repulsionShift) - (c6s * dispersionShift)),
-                                                 computeValues);
+                            + gmx::selectByMask(((c12s * repulsionShift) - (c6s * dispersionShift)),
+                                                computeValues);
             *force     = gmx::blend(*force, forceQuad, computeValues);
             *potential = gmx::blend(*potential, potentialQuad, computeValues);
             *dvdl      = *dvdl + gmx::selectByMask(dvdlQuad, computeValues);