wham correction of last commits
authorCezary Czaplewski <czarek@chem.univ.gda.pl>
Fri, 22 Jun 2018 20:01:31 +0000 (22:01 +0200)
committerCezary Czaplewski <czarek@chem.univ.gda.pl>
Fri, 22 Jun 2018 20:01:31 +0000 (22:01 +0200)
source/wham/src/energy_p_new.F
source/wham/src/molread_zs.F

index 564542e..4cd3819 100644 (file)
@@ -2948,7 +2948,7 @@ C Evaluate bridge-strain energy and its gradient in virtual-bond and SC vectors.
 C
       implicit real*8 (a-h,o-z)
       include 'DIMENSIONS'
-      include 'DIMENSIONS.ZSCOPT'
+      include 'DIMENSIONS.FREE'
       include 'COMMON.SBRIDGE'
       include 'COMMON.CHAIN'
       include 'COMMON.DERIV'
index c0680d7..c1a6469 100644 (file)
@@ -366,6 +366,8 @@ c-------------------------------------------------------------------------------
       subroutine read_dist_constr
       implicit real*8 (a-h,o-z)
       include 'DIMENSIONS'
+      include 'DIMENSIONS.ZSCOPT'
+      include 'DIMENSIONS.FREE'
       include 'COMMON.CONTROL'
       include 'COMMON.CHAIN'
       include 'COMMON.IOUNITS'