# | Line 175 | Line 175 | Globals::Globals(){ | |
---|---|---|
175 | have_zcons_using_smd = 0; | |
176 | have_seed = 0; | |
177 | have_ljrcut = 0; | |
178 | + | have_minimizer = 0; |
179 | + | have_minimizer_maxiteration = 0; |
180 | + | have_minimizer_writefrq = 0; |
181 | + | have_minimizer_stepsize = 0; |
182 | + | have_minimizer_ftol = 0; |
183 | + | have_minimizer_gtol = 0; |
184 | + | have_minimizer_ls_tol = 0; |
185 | + | have_minimizer_ls_maxiteration = 0; |
186 | + | |
187 | ||
188 | } | |
189 | ||
# | Line 1655 | Line 1664 | char* Globals::checkMe( void ){ | |
1664 | strcat( err, "\t->targetTemp\n" ); | |
1665 | have_err= 1; | |
1666 | } | |
1658 | – | |
1667 | ||
1668 | if(!have_minimizer) | |
1669 | if( !have_ensemble ){ |
– | Removed lines |
+ | Added lines |
< | Changed lines |
> | Changed lines |