& mmaxtheterm=maxtheterm)
c Max number of torsional terms in SCCOR
integer maxterm_sccor
- parameter (maxterm_sccor=3)
+ parameter (maxterm_sccor=6)
C Max. number of lobes in SC distribution
integer maxlob
parameter (maxlob=4)
parameter (max_pool=10)
C Number of energy components
integer n_ene,n_ene2
- parameter (n_ene=23,n_ene2=2*n_ene)
+ parameter (n_ene=28,n_ene2=2*n_ene)
C Number of threads in deformation
integer max_thread,max_thread2
parameter (max_thread=4,max_thread2=2*max_thread)
C Maximum number of chains
integer mxch
parameter (mxch=1)
-C Maximum number of generated conformations
- integer mxio
- parameter (mxio=2)
-C Maximum number of n7 generated conformations
- integer mxio2
- parameter (mxio2=2)
-C Maximum number of moves (n1-n8)
- integer mxmv
- parameter (mxmv=18)
-C Maximum number of seed
- integer max_seed
- parameter (max_seed=1)
+csaC Maximum number of generated conformations
+csa integer mxio
+csa parameter (mxio=2)
+csaC Maximum number of n7 generated conformations
+csa integer mxio2
+csa parameter (mxio2=2)
+csaC Maximum number of moves (n1-n8)
+csa integer mxmv
+csa parameter (mxmv=18)
+csaC Maximum number of seed
+csa integer max_seed
+csa parameter (max_seed=1)
C Maximum number of timesteps for which stochastic MD matrices can be stored
integer maxflag_stoch
parameter (maxflag_stoch=0)
C Nose-Hoover chain - chain length and order of Yoshida algorithm
integer maxmnh,maxyosh
parameter(maxmnh=10,maxyosh=5)
+C Maximum number of templates in homology-modeling restraints
+ integer max_template
+ parameter(max_template=25)