![]() |
BUGLIST for
DLPROTEIN 2.1 |
1 - The parallel version of fftw library does not work on alpha (64 bit ) machine (fixed in release 2.1r2)
2 - In the FIELD file if Ions are placed
before water molecules a lot of warnings are printed in utaylor_mod.F90.
This is harmless (fixed in release 2.1r2)
Version 2.1r2
1 - A stupid typo is present in the Makefile at the following lines
##### FastFourierTrasform (PUBFFT/FFTW/FFTW_MPI/SGIFFT/SP3FFT)
#
PUBFFT : use the pubfft.f file in the dlprotein distribution
#
SGIFFT : use the SGI fft routines
#
PCCFFT : use the SP3 fft parallel routines
#
FTTW : use the FFTW routines (serial version)
^^^^
#
FTTW_MPI: use the FFTW routines (parallel version)
^^^^
#
default: PUBFFT
The two underlined words must be read as:
FFTW
This means that the right precompiler
flag to use FFTW library is
FFTW ( not FTTW !!). It will be fixed
next release