From 3620b20e4b438f3c32ba3f48e5760444b455d1e4 Mon Sep 17 00:00:00 2001 From: Amrita Goswami Date: Mon, 5 Nov 2018 16:39:19 +0530 Subject: [PATCH] molSys: Added a new function for reading in the box dimenions from an input line, for saving the box lengths at each step --- molecular_system.h | 3 +++ 1 file changed, 3 insertions(+) diff --git a/molecular_system.h b/molecular_system.h index c763a8e1..61057421 100755 --- a/molecular_system.h +++ b/molecular_system.h @@ -68,6 +68,9 @@ class CMolecularSystem { // function void readParticleFile(int ); + // Reads in the box dimensions from the lammps trajectory + double getBoxLength(std::string ); + }; #endif