1 ******************************************************************
3 * Array dimensions for the clustering programs:
5 * Max. number of conformations in the data set.
7 PARAMETER (MAXCONF=2500)
9 * Max. number of "distances" between conformations.
11 PARAMETER (MAXDIST=(MAXCONF*(MAXCONF-1))/2)
13 * Max. number of clusters. Should be set to MAXCONF; change only if there are
14 * problems with memory. In such a case be suspicious about the results, however!
16 PARAMETER (MAXGR=MAXCONF)
18 * Max. number of conformations in a cluster. Remark above applies also here.
20 PARAMETER (MAXINGR=MAXCONF)
22 * Max. number of cut-off values
26 * Max. number of properties
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