Dear AmberUsers,
I am trying to build the parameter files for an amino-acid metal complex. To
build the parameters, i am using MCPB as suggested in an earlier mail. The tool
seems to have installed properly. However, I encounter an error when i run the
following command (using the example scripts provided in the data folder)
> MCPB -i 1AMP_OH_sidechain.bcl -l 1AMP_OH_sidechain.bcl.log
I get the following error :
terminate called after throwing an instance of 'std::logic_error'
what(): basic_string::_S_construct NULL not valid
Aborted
I suppose it has something to do with the boost library. Could some one please
suggest me some solutions. I am attaching the 1AMP_OH_sidechain.bcl file
(however, it is the same as provided in the data folder)
Thanks and Regards
Soma Ghosh
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Received on Sun Nov 27 2011 - 22:30:03 PST
