test Success Antechamber

Task Info

Created Time

4/29/2022 9:49:25 AM

Updated Time

4/29/2022 9:49:39 AM


Output Files


Output Message

Welcome to antechamber 20.0: molecular input file processor. Warning: The assigned bond types may be wrong, please : (1) double check the structure (the connectivity) and/or (2) adjust atom valence penalty parameters in APS.DAT, and/or (3) increase PSCUTOFF in define.h and recompile bondtype.c (be cautious, using a large value of PSCUTOFF (>100) will significantly increase the computation time).

Error Message