Skip to content
Snippets Groups Projects
Commit af748745 authored by Axel Kohlmeyer's avatar Axel Kohlmeyer
Browse files

rename references to USER-CG-CMM to USER-CGSDK

parent 949d61e0
No related branches found
No related tags found
No related merge requests found
...@@ -515,7 +515,7 @@ the packages they have written are somewhat unique to LAMMPS and the ...@@ -515,7 +515,7 @@ the packages they have written are somewhat unique to LAMMPS and the
code would not be as general-purpose as it is without their expertise code would not be as general-purpose as it is without their expertise
and efforts. and efforts.
Axel Kohlmeyer (Temple U), akohlmey at gmail.com, SVN and Git repositories, indefatigable mail list responder, USER-CG-CMM and USER-OMP packages Axel Kohlmeyer (Temple U), akohlmey at gmail.com, SVN and Git repositories, indefatigable mail list responder, USER-CGSDK and USER-OMP packages
Roy Pollock (LLNL), Ewald and PPPM solvers Roy Pollock (LLNL), Ewald and PPPM solvers
Mike Brown (ORNL), brownw at ornl.gov, GPU package Mike Brown (ORNL), brownw at ornl.gov, GPU package
Greg Wagner (Sandia), gjwagne at sandia.gov, MEAM package for MEAM potential Greg Wagner (Sandia), gjwagne at sandia.gov, MEAM package for MEAM potential
......
...@@ -1139,8 +1139,8 @@ The current list of user-contributed packages is as follows: ...@@ -1139,8 +1139,8 @@ The current list of user-contributed packages is as follows:
Package, Description, Author(s), Doc page, Example, Pic/movie, Library Package, Description, Author(s), Doc page, Example, Pic/movie, Library
"USER-ATC"_#USER-ATC, atom-to-continuum coupling, Jones & Templeton & Zimmerman (1), "fix atc"_fix_atc.html, USER/atc, "atc"_atc, lib/atc "USER-ATC"_#USER-ATC, atom-to-continuum coupling, Jones & Templeton & Zimmerman (1), "fix atc"_fix_atc.html, USER/atc, "atc"_atc, lib/atc
"USER-AWPMD"_#USER-AWPMD, wave-packet MD, Ilya Valuev (JIHT), "pair_style awpmd/cut"_pair_awpmd.html, USER/awpmd, -, lib/awpmd "USER-AWPMD"_#USER-AWPMD, wave-packet MD, Ilya Valuev (JIHT), "pair_style awpmd/cut"_pair_awpmd.html, USER/awpmd, -, lib/awpmd
"USER-CG-CMM"_#USER-CG-CMM, coarse-graining model, Axel Kohlmeyer (Temple U), "pair_style lj/sdk"_pair_sdk.html, USER/cg-cmm, "cg"_cg, -
"USER-CGDNA"_#USER-CGDNA, coarse-grained DNA force fields, Oliver Henrich (U Strathclyde Glasgow), src/USER-CGDNA/README, USER/cgdna, -, - "USER-CGDNA"_#USER-CGDNA, coarse-grained DNA force fields, Oliver Henrich (U Strathclyde Glasgow), src/USER-CGDNA/README, USER/cgdna, -, -
"USER-CGSDK"_#USER-CGSDK, SDK coarse-graining model, Axel Kohlmeyer (Temple U), "pair_style lj/sdk"_pair_sdk.html, USER/cgsdk, "cgsdk"_cgsdk, -
"USER-COLVARS"_#USER-COLVARS, collective variables, Fiorin & Henin & Kohlmeyer (2), "fix colvars"_fix_colvars.html, USER/colvars, "colvars"_colvars, lib/colvars "USER-COLVARS"_#USER-COLVARS, collective variables, Fiorin & Henin & Kohlmeyer (2), "fix colvars"_fix_colvars.html, USER/colvars, "colvars"_colvars, lib/colvars
"USER-DIFFRACTION"_#USER-DIFFRACTION, virutal x-ray and electron diffraction, Shawn Coleman (ARL),"compute xrd"_compute_xrd.html, USER/diffraction, -, - "USER-DIFFRACTION"_#USER-DIFFRACTION, virutal x-ray and electron diffraction, Shawn Coleman (ARL),"compute xrd"_compute_xrd.html, USER/diffraction, -, -
"USER-DPD"_#USER-DPD, reactive dissipative particle dynamics (DPD), Larentzos & Mattox & Brennan (5), src/USER-DPD/README, USER/dpd, -, - "USER-DPD"_#USER-DPD, reactive dissipative particle dynamics (DPD), Larentzos & Mattox & Brennan (5), src/USER-DPD/README, USER/dpd, -, -
...@@ -1169,7 +1169,7 @@ Package, Description, Author(s), Doc page, Example, Pic/movie, Library ...@@ -1169,7 +1169,7 @@ Package, Description, Author(s), Doc page, Example, Pic/movie, Library
:tb(ea=c) :tb(ea=c)
:link(atc,http://lammps.sandia.gov/pictures.html#atc) :link(atc,http://lammps.sandia.gov/pictures.html#atc)
:link(cg,http://lammps.sandia.gov/pictures.html#cg) :link(cgsdk,http://lammps.sandia.gov/pictures.html#cg)
:link(eff,http://lammps.sandia.gov/movies.html#eff) :link(eff,http://lammps.sandia.gov/movies.html#eff)
:link(manifold,http://lammps.sandia.gov/movies.html#manifold) :link(manifold,http://lammps.sandia.gov/movies.html#manifold)
:link(sph,http://lammps.sandia.gov/movies.html#sph) :link(sph,http://lammps.sandia.gov/movies.html#sph)
...@@ -1267,18 +1267,18 @@ physik.hu-berlin.de). Contact him directly if you have questions. ...@@ -1267,18 +1267,18 @@ physik.hu-berlin.de). Contact him directly if you have questions.
:line :line
USER-CG-CMM package :link(USER-CG-CMM),h5 USER-CGSDK package :link(USER-CGSDK),h5
Contents: CG-CMM stands for coarse-grained ??. This package Contents: CGSDK stands for Shinoda-DeVane-Klein (SDK) coarse-grained
implements several pair styles and an angle style using the coarse molecular dynamics force field. This package implements several pair
grained parametrization of Shinoda, DeVane, Klein, Mol Sim, 33, 27 styles and an angle style using the coarse grained parametrization of
(2007) (SDK), with extensions to simulate ionic liquids, electrolytes, Shinoda, DeVane, Klein, Mol Sim, 33, 27 (2007) (SDK), with extensions
lipids and charged amino acids. See src/USER-CG-CMM/README for more to simulate ionic liquids, electrolytes, lipids and charged amino acids.
details. See src/USER-CGSDK/README for more details.
Supporting info: src/USER-CG-CMM/README, "pair lj/sdk"_pair_sdk.html, Supporting info: src/USER-CGSDK/README, "pair lj/sdk"_pair_sdk.html,
"pair lj/sdk/coul/long"_pair_sdk.html, "angle sdk"_angle_sdk.html, "pair lj/sdk/coul/long"_pair_sdk.html, "angle sdk"_angle_sdk.html,
examples/USER/cg-cmm examples/USER/cgsdk
Author: Axel Kohlmeyer at Temple U (akohlmey at gmail.com). Contact Author: Axel Kohlmeyer at Temple U (akohlmey at gmail.com). Contact
him directly if you have questions. him directly if you have questions.
...@@ -1329,10 +1329,12 @@ src/USER-COLVARS/README, lib/colvars/README, "fix ...@@ -1329,10 +1329,12 @@ src/USER-COLVARS/README, lib/colvars/README, "fix
colvars"_fix_colvars.html, examples/USER/colvars colvars"_fix_colvars.html, examples/USER/colvars
Authors: Axel Kohlmeyer at Temple U (akohlmey at gmail.com) wrote the Authors: Axel Kohlmeyer at Temple U (akohlmey at gmail.com) wrote the
fix. The COLVARS library itself is written and maintained by Giacomo interface that integrates colvars into LAMMPS. The COLVARS library
Fiorin (ICMS, Temple University, Philadelphia, PA, USA) and Jerome itself is written and maintained by Giacomo Fiorin (ICMS, Temple
Henin (LISM, CNRS, Marseille, France). Contact them directly if you University, Philadelphia, PA, USA) and Jerome Henin (LISM, CNRS,
have questions. Marseille, France). For more info, and to communicate with the COLVARS
developers, please go to COLVARS home page at
"http://colvars.github.io"_http://colvars.github.io/.
:line :line
......
...@@ -46,7 +46,7 @@ from the pair_style. ...@@ -46,7 +46,7 @@ from the pair_style.
[Restrictions:] [Restrictions:]
This angle style can only be used if LAMMPS was built with the This angle style can only be used if LAMMPS was built with the
USER-CG-CMM package. See the "Making USER-CGSDK package. See the "Making
LAMMPS"_Section_start.html#start_3 section for more info on packages. LAMMPS"_Section_start.html#start_3 section for more info on packages.
[Related commands:] [Related commands:]
......
...@@ -134,7 +134,7 @@ respa"_run_style.html command. ...@@ -134,7 +134,7 @@ respa"_run_style.html command.
[Restrictions:] [Restrictions:]
All of the lj/sdk pair styles are part of the USER-CG-CMM package. All of the lj/sdk pair styles are part of the USER-CGSDK package.
The {lj/sdk/coul/long} style also requires the KSPACE package to be The {lj/sdk/coul/long} style also requires the KSPACE package to be
built (which is enabled by default). They are only enabled if LAMMPS built (which is enabled by default). They are only enabled if LAMMPS
was built with that package. See the "Making was built with that package. See the "Making
......
0% Loading or .
You are about to add 0 people to the discussion. Proceed with caution.
Finish editing this message first!
Please register or to comment