Merge pull request #620 from amilumas/master
b1706060529b
Actions

Authored by Steve Plimpton <sjplimp@sandia.gov> on Sep 5 2017, 18:08.

Description

Merge pull request #620 from amilumas/master

Temper_NPT

Committed

GitHub <noreply@github.com>

Sep 5 2017, 18:08

Pushed

junge

Oct 19 2017, 09:53

Parents

Branches

Unknown

Tags

Unknown

GitHub <noreply@github.com> committed rLAMMPSb1706060529b: Merge pull request #620 from amilumas/master (authored by Steve Plimpton <sjplimp@sandia.gov>).Sep 5 2017, 18:08

Commit	Author	Details	Committed
397bc225b27c	Axel Kohlmeyer	add temper/npt to src/USER-MISC/README	Aug 31 2017
d9d9ba824474	Axel Kohlmeyer	update .gitignore	Aug 31 2017
eba4be18c29a	Axel Kohlmeyer	adapt formatting and naming conventions to fully match LAMMPS style. allow…	Aug 31 2017
4d2ed30b3526	Axel Kohlmeyer	add reference outputs to temper/npt example	Aug 31 2017
f3dda30f8ef3	Axel Kohlmeyer	fully integrate temper/npt command into manual	Aug 31 2017
f57d19492051	Amulya/GitHub	Add files via upload	Aug 29 2017
6a4bbddb3b7a	Amulya/GitHub	Add files via upload	Aug 28 2017
2add18e013dd	Amulya/GitHub	Create in.temper_npt	Aug 28 2017
d0efd3a422ab	Amulya/GitHub	Add files via upload	Aug 28 2017
822bffdfaeef	Amulya/GitHub	Merge pull request #1 from amilumas/temper_npt	Aug 18 2017
6aa756968d40	Amulya/GitHub	Temper_NPT and example	Aug 18 2017

		Path
M		doc/src/Section_commands.txt
M		doc/src/commands.txt
M		doc/src/lammps.book
A		doc/src/temper_npt.txt
A	(dir)	examples/USER/misc/temper_npt/
P		examples/USER/misc/temper_npt/data.peptide Copied from examples/USER/colvars/data.peptide
A		examples/USER/misc/temper_npt/in.temper_npt
A		examples/USER/misc/temper_npt/log.temper_npt-17Aug17.g++.8
A		examples/USER/misc/temper_npt/log.temper_npt-17Aug17.g++.8.0
A		examples/USER/misc/temper_npt/log.temper_npt-17Aug17.g++.8.1
A		examples/USER/misc/temper_npt/log.temper_npt-17Aug17.g++.8.2
A		examples/USER/misc/temper_npt/log.temper_npt-17Aug17.g++.8.3
A		examples/USER/misc/temper_npt/log.temper_npt-17Aug17.g++.8.4
A		examples/USER/misc/temper_npt/log.temper_npt-17Aug17.g++.8.5
A		examples/USER/misc/temper_npt/log.temper_npt-17Aug17.g++.8.6
A		examples/USER/misc/temper_npt/log.temper_npt-17Aug17.g++.8.7
M		src/.gitignore
P		src/REPLICA/data.peptide Copied from examples/USER/colvars/data.peptide
A		src/REPLICA/in.temper_npt
A		src/REPLICA/temper_npt.cpp
A		src/REPLICA/temper_npt.h
M		src/USER-MISC/README
A		src/USER-MISC/temper_npt.cpp
A		src/USER-MISC/temper_npt.h