From 5d88e125832b22de58f2aefe2f1cafa0c04dd51d Mon Sep 17 00:00:00 2001 From: Axel Kohlmeyer Date: Wed, 25 Sep 2019 14:33:07 -0400 Subject: [PATCH] correct model comment and remove trailing whitespace --- examples/gcmc/CO2.txt | 14 +++++++------- examples/gcmc/H2O.txt | 14 +++++++------- 2 files changed, 14 insertions(+), 14 deletions(-) diff --git a/examples/gcmc/CO2.txt b/examples/gcmc/CO2.txt index 72e593e3f2..c9fb8616c2 100644 --- a/examples/gcmc/CO2.txt +++ b/examples/gcmc/CO2.txt @@ -12,15 +12,15 @@ Coords Types -1 1 -2 2 -3 2 +1 1 +2 2 +3 2 -Charges +Charges -1 0.7 -2 -0.35 -3 -0.35 +1 0.7 +2 -0.35 +3 -0.35 Bonds diff --git a/examples/gcmc/H2O.txt b/examples/gcmc/H2O.txt index b56f869693..e5a5e4fe93 100644 --- a/examples/gcmc/H2O.txt +++ b/examples/gcmc/H2O.txt @@ -1,4 +1,4 @@ -# CO2 molecule file. TraPPE model. +# Water molecule. SPC/E model. 3 atoms 2 bonds @@ -12,15 +12,15 @@ Coords Types -1 1 -2 2 -3 2 +1 1 +2 2 +3 2 -Charges +Charges 1 -0.8472 -2 0.4236 -3 0.4236 +2 0.4236 +3 0.4236 Bonds