[Xplor-nih] maximum allocation size for free HB entries exceeded

[Charles at Schwieters.org]

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Hello Jakob--

> 
> I am getting an error while using MARVIN/PASD in conjunction with the  
> HDBD term.
> ca. 1/50 of the structure calculations crashes with the message:
> "%READHBDB-ERR: maximum allocation size for free HB entries exceeded"
> 

this is due to programming error. Here h-bonds are determined on the
fly, and the number of these is exceeding the maximum allowed by the
program. I will fix the code to remove this limit shortly. Please let me
know which platform you are running on, and I'll send you a test binary
shortly.

best regards--
Charles
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