diff --git a/tools/README b/tools/README index 78edb24174..09696c4b85 100644 --- a/tools/README +++ b/tools/README @@ -12,19 +12,23 @@ at. These are the included tools: -amber2lammps python scripts for using AMBER to setup LAMMPS input +amber2lmp python scripts for using AMBER to setup LAMMPS input binary2txt convert a LAMMPS dump file from binary to ASCII text ch2lmp convert CHARMM files to LAMMPS input chain create a data file of bead-spring chains data2xmovie convert a data file to a snapshot that xmovie can viz +eam_generate generate EAM potential files lmp2arc convert LAMMPS output to Accelrys Insight format lmp2cfg convert LAMMPS output to CFG files for AtomEye viz lmp2traj convert LAMMPS output to contour, density profiles lmp2vmd tools for visualizing and analyzing LAMMPS data with VMD +matlab MatLab scripts for post-processing LAMMPS output micelle2d create a data file of small lipid chains in solvent msi2lmp use Accelrys Insight code to setup LAMMPS input pymol_asphere convert LAMMPS output of ellipsoids to PyMol format +python Python scripts for post-processing LAMMPS output restart2data convert a binary restart file to an input data file +thermo_extract C program for extracting thermo info from log file vim add-ons to VIM editor for editing LAMMPS input scripts xmovie a quick/simple viz package (2d projections of 3d) diff --git a/tools/restart2data.cpp b/tools/restart2data.cpp index 92b49f6911..84021e545a 100644 --- a/tools/restart2data.cpp +++ b/tools/restart2data.cpp @@ -409,7 +409,7 @@ int main (int argc, char **argv) void header(FILE *fp, Data &data) { - char *version = "22 Jan 2008"; + char *version = "21 May 2008"; data.triclinic = 0;