From: Adam Sieradzan <adasko@piasek4.chem.univ.gda.pl>
Date: Mon, 8 May 2017 09:37:47 +0000 (+0200)
Subject: comment printout
X-Git-Url: http://mmka.chem.univ.gda.pl/gitweb/?p=unres.git;a=commitdiff_plain;h=dee4d9f5939ebbab46c521dbe5077e69dd4f0bc0

comment printout
---

diff --git a/source/unres/src_MD-M/energy_p_new_barrier.F b/source/unres/src_MD-M/energy_p_new_barrier.F
index 3703b07..2647bce 100644
--- a/source/unres/src_MD-M/energy_p_new_barrier.F
+++ b/source/unres/src_MD-M/energy_p_new_barrier.F
@@ -12398,7 +12398,7 @@ C THIS FRAGMENT MAKES TUBE FINITE
 C       print *,mod(c(3,i+nres),boxzsize),bordlipbot,bordliptop
 c for each residue check if it is in lipid or lipid water border area
 C       respos=mod(c(3,i+nres),boxzsize)
-       print *,positi,bordtubebot,buftubebot,bordtubetop
+C       print *,positi,bordtubebot,buftubebot,bordtubetop
        if ((positi.gt.bordtubebot)
      & .and.(positi.lt.bordtubetop)) then
 C the energy transfer exist
@@ -12408,7 +12408,7 @@ C the energy transfer exist
 C lipbufthick is thickenes of lipid buffore
          sstube=sscalelip(fracinbuf)
          ssgradtube=-sscagradlip(fracinbuf)/tubebufthick
-         print *,ssgradtube, sstube,tubetranene(itype(i))
+C         print *,ssgradtube, sstube,tubetranene(itype(i))
          enetube(i)=enetube(i)+sstube*tubetranenepep
 C         gg_tube_SC(3,i)=gg_tube_SC(3,i)
 C     &+ssgradtube*tubetranene(itype(i))
@@ -12486,7 +12486,8 @@ C THIS FRAGMENT MAKES TUBE FINITE
 C       print *,mod(c(3,i+nres),boxzsize),bordlipbot,bordliptop
 c for each residue check if it is in lipid or lipid water border area
 C       respos=mod(c(3,i+nres),boxzsize)
-       print *,positi,bordtubebot,buftubebot,bordtubetop
+C       print *,positi,bordtubebot,buftubebot,bordtubetop
+
        if ((positi.gt.bordtubebot)
      & .and.(positi.lt.bordtubetop)) then
 C the energy transfer exist
@@ -12496,7 +12497,7 @@ C the energy transfer exist
 C lipbufthick is thickenes of lipid buffore
          sstube=sscalelip(fracinbuf)
          ssgradtube=-sscagradlip(fracinbuf)/tubebufthick
-         print *,ssgradtube, sstube,tubetranene(itype(i))
+C         print *,ssgradtube, sstube,tubetranene(itype(i))
          enetube(i+nres)=enetube(i+nres)+sstube*tubetranene(itype(i))
 C         gg_tube_SC(3,i)=gg_tube_SC(3,i)
 C     &+ssgradtube*tubetranene(itype(i))