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After updating to the 20210527 release of LCModel, .lcmodel/bin/makebasis no longer ran on makebasis.in files that had previously run successfully. I found that two parameters in the .RAW files produced by FID-A needed single quotation marks around them in order to run: $NMID ID and FMTDAT. So, what originally read $NMID ID=Ala should read $NMID ID='Ala' and what read FMTDAT=(2E16.6) should read FMTDAT='(2E16.6)'. When I manually changed this, the makebasis script ran as expected.
The text was updated successfully, but these errors were encountered:
After updating to the 20210527 release of LCModel, .lcmodel/bin/makebasis no longer ran on makebasis.in files that had previously run successfully. I found that two parameters in the .RAW files produced by FID-A needed single quotation marks around them in order to run: $NMID ID and FMTDAT. So, what originally read $NMID ID=Ala should read $NMID ID='Ala' and what read FMTDAT=(2E16.6) should read FMTDAT='(2E16.6)'. When I manually changed this, the makebasis script ran as expected.
The text was updated successfully, but these errors were encountered: