Fix Colvars output files not written with "run 0"

Browse Source

See:
  https://github.com/Colvars/colvars/commit/ff2f0d39ee5
which fixes a bug introduced in:
  https://github.com/Colvars/colvars/commit/1e964a542b

The message applies to NAMD, but the logic used in LAMMPS when handling "run 0" is very similar.

The Colvars version string is also updated, however this commit does not
include other changes, such as the following:
  https://github.com/Colvars/colvars/pull/419
which were not fully completed before the LAMMPS Summer 2021 finalization.

...

This commit is contained in:

Giacomo Fiorin

2021-09-27 13:32:11 -04:00

parent 7b11f916b7

commit 7601001632

3 changed files with 4 additions and 2 deletions

Show all changes Ignore whitespace when comparing lines Ignore changes in amount of whitespace Ignore changes in whitespace at EOL

Download Patch File Download Diff File Expand all files Collapse all files

BIN

doc/src/PDF/colvars-refman-lammps.pdf

Binary file not shown.