Hi,
dcqtp/src/tools/pwdecomp.F90
has compilation errors on ifort_ia32. These appear to be simple
literal string issues in line continued format statements.
What is the policy on dcqtp commits to the Amber cvs repository ?
ifort -c -std95 -vec_report0 -mp1 -ip -O3 -axNP -FR -I../../sander -I../src/include -DHAS_LAPACK -DQMMM -o ../obj/pwdecomp.o ../src/tools/pwdecomp.F90
fortcom: Info: pwdecomp.F90, line 70: Text exceeds standard right hand column
write(iout,'(//" A PAIRWISE ENERGY DECOMPOSITION HAS BEEN ", "REQUESTED.", /" THE RESULTS OF THIS DECOMPOSITION WILL BE WRITTEN ", "TO ",A20)'&
....................................................................................................................................^
fortcom: Error: pwdecomp.F90, line 652: This character is not valid in a format list. [&]
write(iff,'("# Pairwise Energy Decomposition.", /"# ",/"# ",/"# 1. Atomic Interactions (in eV).", /"# -------------------------------",/"# ", /"# Etot = SUM(A) [ E_A + SUM(B<A) [ E_AB",a1," + ", "E_AB + Ecore_AB ] ]",/"# ", &
^
fortcom: Error: pwdecomp.F90, line 852: This character is not valid in a format list. [&]
write(iff,'(//"# 4B. Inter-residue interactions.",/,"# ", /"# Eres_IJ = SUM(A) SUM(B) [ E_AB",a1, " + E_AB + Ecore_AB ] A E I; B E J", /"# ", /"# Note that R_IJ is the distance between the ", &
^
fortcom: Error: pwdecomp.F90, line 915: This character is not valid in a format list. [&]
write(iff,'(//"# 5. Residue Energies (in eV).", /"# ----------------------------", /"# ", /"# Etot = SUM(I) [ Eres_I",a1," ]", 20x,"A E I; B E (I,J,...)", /"# Eres_I",a1," = SUM(A) [ E_A + 0.5 SUM(B!=&
^
compilation aborted for ../src/tools/pwdecomp.F90 (code 1)
# AMBER Makefile configuration for compiler/architecture: ifort_ia32
# Generated via command: ./configure -bintraj ifort_ia32
Mar 06 1:30:37pm bohr 290> ~/10/src uname -a
Linux bohr 2.4.26 #7 SMP Thu Jul 8 10:44:00 PDT 2004 i686 i686 i386 GNU/Linux
Mar 06 1:31:05pm bohr 292> ~/10/src ifort -V
Intel(R) Fortran Compiler for 32-bit applications, Version 8.0 Build 20031016Z Package ID: l_fc_p_8.0.034
Copyright (C) 1985-2003 Intel Corporation. All rights reserved.
Mar 06 1:31:09pm bohr 293> ~/10/src cat /etc/redhat-release
Red Hat Linux release 9 (Shrike)
Scott
Received on Wed Mar 07 2007 - 06:07:45 PST
