numerical gradient delta 10e-4
[unres.git] / source / unres / src_MD-M / COMMON.LANGEVIN
1        double precision friction(3,0:MAXRES2),stochforc(3,0:MAXRES2),
2      & fricmat(MAXRES2,MAXRES2),fric_work(MAXRES6),
3      & stoch_work(MAXRES6),
4      & fricgam(MAXRES6),fricvec(MAXRES2,MAXRES2),
5      & pfric_mat(MAXRES2,MAXRES2),vfric_mat(MAXRES2,MAXRES2),
6      & afric_mat(MAXRES2,MAXRES2),prand_mat(MAXRES2,MAXRES2),
7      & vrand_mat1(MAXRES2,MAXRES2),vrand_mat2(MAXRES2,MAXRES2),
8      & pfric0_mat(MAXRES2,MAXRES2,0:maxflag_stoch),
9      & afric0_mat(MAXRES2,MAXRES2,0:maxflag_stoch),
10      & vfric0_mat(MAXRES2,MAXRES2,0:maxflag_stoch),
11      & prand0_mat(MAXRES2,MAXRES2,0:maxflag_stoch),
12      & vrand0_mat1(MAXRES2,MAXRES2,0:maxflag_stoch),
13      & vrand0_mat2(MAXRES2,MAXRES2,0:maxflag_stoch),
14      & mt1(maxres2,maxres2),mt2(maxres2,maxres2),mt3(maxres2,maxres2)
15        logical flag_stoch(0:maxflag_stoch)
16       common /langforc/ friction,stochforc,
17      & fricmat,fric_work,fricgam,stoch_work,fricvec,vrand_mat1,
18      & vrand_mat2,prand_mat,vfric_mat,afric_mat,pfric_mat,
19      & pfric0_mat,afric0_mat,vfric0_mat,prand0_mat,vrand0_mat1,
20      & vrand0_mat2,flag_stoch
21       common /langmat/ mt1,mt2,mt3