1 integer maxstr,max_ene,maxprot,maxfile_prot,
3 c Maximum number of structures in the database, energy components, proteins,
4 c and structural classes
5 parameter (maxstr=200000,max_ene=25,maxprot=9)
6 c Maximum number of structures to be dealt with by one processor
7 parameter (maxstr_proc=10000)
8 c Maximum number of temperatures
11 c Maximum number of temperatures at which to compute maximum likelihood function
13 parameter (maxT_lik=10)
14 c Maximum dimension of property of like kind
16 parameter (maxdimnat=1)
17 c Maximum number of properties
19 parameter (maxnatlike=5)
20 c Maximum number of series of data
22 parameter (maxbatch=maxnatlike+2)
23 c Maximum number of reference structures
25 parameter (maxref=600)
26 c Maximum number of files with energies/coordinates
27 parameter (maxfile_prot=100)
28 c Maximum number of processors
30 parameter (MaxProcs = 4096)
31 c Maximum number of optimizable parameters
33 parameter (max_paropt=1500)
34 c Maximum number of grid points in temperature
36 parameter (MaxGridT=2000)
37 c Maximum number of PMF points
39 parameter (maxpoint=1500000)