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bug fix for reading the topology file when using large solvents #1704

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bug fix for reading the topology file when using large solvents

bug fix for reading the topology file when using large solvents #1704

Run time

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Job Run time
build (build_openblas, 8, ubuntu-20.04, false, openmpi, MPI-TS, 13.2.1, tinyqmpw python, gfortran)
1h 27m 10s
build (build_openblas, 8, ubuntu-20.04, false, openmpi, MPI-TS, 13.2.1, qmandpw qmd, gfortran)
1h 10m 37s
build (build_openblas, 8, ubuntu-20.04, false, openmpi, MPI-TS, 13.2.1, tce, gfortran)
19m 3s
build (build_openblas, 8, ubuntu-20.04, false, mpich, MPI-TS, 13.2.1, tinyqmpw python, gfortran)
1h 37m 32s
build (build_openblas, 8, ubuntu-20.04, false, mpich, MPI-TS, 13.2.1, qmandpw qmd, gfortran)
1h 36m 45s
build (build_openblas, 8, ubuntu-20.04, false, mpich, MPI-TS, 13.2.1, tce, gfortran)
19m 29s
build (build_openblas, 8, macos-11, false, openmpi, MPI-TS, 13.2.1, tinyqmpw python, gfortran)
1h 9m 33s
build (build_openblas, 8, macos-11, false, openmpi, MPI-TS, 13.2.1, qmandpw qmd, gfortran)
1h 10m 39s
build (build_openblas, 8, macos-11, false, openmpi, MPI-TS, 13.2.1, tce, gfortran)
30m 2s
build (build_openblas, 8, macos-11, false, mpich, MPI-TS, 13.2.1, tce, gfortran)
1h 18m 59s
build (ubuntu-20.04, true, openmpi, MPI-TS, xtb qmd driver solvation, gfortran-9, build_openblas,...
1h 19m 59s
build (ubuntu-20.04, true, mpich, MPI-TS, xtb driver solvation, gfortran-11, build_openblas, 4, g...
1h 22m 49s
build (ubuntu-20.04, true, openmpi, MPI-TS, xtb driver solvation, gfortran-9, build_openblas, 2, 1)
1h 11m 27s
build (ubuntu-20.04, true, intel, MPI-TS, xtb driver solvation, ifort, build_openblas, 4, 2, 1)
13m 16s
build (ubuntu-20.04, true, intel, MPI-TS, xtb driver solvation, ifort, 2, 1)
12m 51s
build (ubuntu-20.04, true, mpich, MPI-TS, xtb driver solvation, nvfortran, 2, 1)
1h 16m 44s
build (ubuntu-20.04, true, mpich, ARMCI, all, gfortran, build_openblas)
1h 35m 52s
build (ubuntu-20.04, true, mpich, MPI-TS, all, gfortran, internal, 4)
1h 20m 17s
build (ubuntu-20.04, false, mpich, MPI-PR, tinyqmpw python, gfortran-11, gcc-11)
1h 8m 57s
build (ubuntu-22.04, false, mpich, MPI-TS, tce, gfortran-11, gcc-11)
19m 57s
build (ubuntu-20.04, true, mpich, MPI-TS, nwdft solvation driver, gfortran, internal, 8, gcc, -1)
9m 12s
build (ubuntu-22.04, true, mpich, MPI-TS, qmandpw qmd, gfortran-11, gcc-11, -1)
1h 35m 11s
build (ubuntu-20.04, true, mpich, MPI-TS, tinyqmpw python, amdflang, amdclang)
1h 14m 54s
build (ubuntu-20.04, true, mpich, MPI-TS, tce, amdflang, amdclang)
20m 53s
build (ubuntu-22.04, true, intel, MPI-PR, tinyqmpw python, ifort)
1h 18m 13s
build (ubuntu-20.04, true, mpich, MPI-TS, tinyqmpw python, nvfortran, gcc)
1h 39m 10s
build (ubuntu-22.04, true, intel, SOCKETS, tce, ifort)
38m 13s
build (ubuntu-22.04, true, mpich, MPI-TS, tce, flang, clang)
28m 32s
build (ubuntu-22.04, true, intel, MPI-PR, tinyqmpw python, ifort)
1h 33m 52s
build (ubuntu-22.04, true, intel, SOCKETS, tce, ifort)
40m 9s
build (ubuntu-20.04, true, intel, MPI-PR, tinyqmpw python, ifx)
13m 47s
build (ubuntu-20.04, true, mpich, MPI-PT, tinyqmpw python, ifort)
8m 49s
build (ubuntu-20.04, true, intel, SOCKETS, tce, ifx)
13m 0s
build (ubuntu-20.04, true, openmpi, MPI-TS, tinyqmpw, gfortran, gcc, 1)
1h 13m 39s
build (ubuntu-20.04, true, intel, MPI-TS, tinyqmpw, ifort, icx, 1)
12m 45s
build (macos-11, true, openmpi, MPI-TS, tinyqmpw, gfortran-10, gcc, 1)
1h 7m 53s
build (ubuntu-20.04, true, mpich, MPI-PT, nwdft solvation driver, gfortran-10, gcc-10, 1)
39m 43s
build (ubuntu-22.04, true, mpich, MPI-TS, nwdft solvation driver, nvfortran, gcc, 1)
16m 19s
build (ubuntu-22.04, true, intel, MPI-TS, nwdft solvation driver, ifort, icx, 1)
21m 20s
build (ubuntu-20.04, true, mpich, MPI-PR, tinyqmpw python, gfortran-10, gcc-10, 1)
1h 6m 46s
build (macos-11, true, openmpi, MPI-PR, qmandpw qmd, gfortran-10, gcc-10)
28m 54s
build (macos-12, true, openmpi, MPI-PR, tce, gfortran-11, 13.4.1, gcc-11)
35m 10s
build (macos-12, true, openmpi, MPI-TS, tinyqmpw, gfortran-11, 13.4.1)
1h 20m 24s
build (macos-11, true, openmpi, MPI-TS, tinyqmpw, gfortran-9, accelerate, 4)
1h 28m 20s
build (macos-12, true, mpich, MPI-PT, nwdft solvation driver, ifort, 14.0.1)
28m 18s
build (ubuntu-20.04, true, mpich, MPI-TS, qmandpw qmd, gfortran-10, build_openblas, gcc-10, 2)
1h 22m 53s
build (ubuntu-22.04, true, intel, MPI-TS, qmandpw qmd, ifort, 2)
1h 38m 53s
build (ubuntu-20.04, true, mpich, MPI-TS, qmandpw qmd, nvfortran, gcc, 2)
1h 27m 21s
1d 20h 44m 31s