Saturday, April 27 2024 12:38:48
UNRES
0.54s| Exit Value | 1 |
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CTEST_FULL_OUTPUT Bye Bye... Bye Bye... JESTEM JESTEM JESTEM JESTEM JESTEM JESTEM Calling MINIM_DC Calling MINIM_DC LBFGS return code isIterLimit eval 10007 # eval/s 29040.6345870301 refstr= T LBFGS return code isIterLimit eval 10007 # eval/s 28929.2450071130 refstr= T CG processor 0 is finishing work. CG processor 1 is finishing work. initial energy=144.98 reference=127.044 difference 17.936 from reference etot 127.044 greater than 0.01
