ICODE-ADC/lammps
4
0
Fork 0
Code Issues Pull Requests Actions Packages Projects Releases Wiki Activity

git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14829 f3b2605a-c512-4ea7-a41b-209d697bcdaa

Browse Source
This commit is contained in:
sjplimp
2016-04-15 16:07:01 +00:00
parent 32509da721
commit 212a955285
31 changed files with 1713 additions and 1493 deletions
Download Patch File Download Diff File Expand all files Collapse all files

12
lib/colvars/colvarscript.cpp
View File

@ -221,7 +221,7 @@ int colvarscript::proc_colvar(int argc, char const *argv[]) {
if (subcmd == "update") {
cv->calc();
cv->update();
cv->update_forces_energy();
result = (cv->value()).to_simple_string();
return COLVARS_OK;
}
@ -243,6 +243,16 @@ int colvarscript::proc_colvar(int argc, char const *argv[]) {
return COLVARS_OK;
}
if (subcmd == "getappliedforce") {
result = (cv->bias_force()).to_simple_string();
return COLVARS_OK;
}
if (subcmd == "getsystemforce") {
result = (cv->system_force()).to_simple_string();
return COLVARS_OK;
}
if (subcmd == "addforce") {
if (argc < 4) {
result = "addforce: missing parameter: force value\n" + help_string();