cd evb/malon_bond_umb_GAFF && ./Run.evb Running multisander version of sander amber10 Total processors = 2 Number of groups = 2 diffing mr.out.save with mr.out PASSED ============================================================== diffing mp.out.save with mp.out PASSED ============================================================== diffing evbout.save with evbout PASSED ============================================================== cd evb/malon_bond_umb_GAFF_MORSIFY && ./Run.evb Running multisander version of sander amber10 Total processors = 2 Number of groups = 2 diffing mr.out.save with mr.out PASSED ============================================================== diffing mp.out.save with mp.out PASSED ============================================================== diffing evbout.save with evbout PASSED ============================================================== cd evb/malon_bond_umb_GAFF_MORSIFY_XVDW && ./Run.evb Running multisander version of sander amber10 Total processors = 2 Number of groups = 2 diffing mr.out.save with mr.out PASSED ============================================================== diffing mp.out.save with mp.out PASSED ============================================================== diffing evbout.save with evbout PASSED ============================================================== cd evb/malon_dbonds_umb_GAFF && ./Run.evb Running multisander version of sander amber10 Total processors = 2 Number of groups = 2 diffing mr.out.save with mr.out PASSED ============================================================== diffing mp.out.save with mp.out PASSED ============================================================== diffing evbout.save with evbout PASSED ============================================================== cd evb/malon_dbonds_umb_GAFF_MORSIFY && ./Run.evb Running multisander version of sander amber10 Total processors = 2 Number of groups = 2 diffing mr.out.save with mr.out PASSED ============================================================== diffing mp.out.save with mp.out PASSED ============================================================== diffing evbout.save with evbout PASSED ============================================================== cd evb/malon_dbonds_umb_GAFF_MORSIFY_nmpimd_full && ./Run.evb Running multisander version of sander amber10 Total processors = 2 Number of groups = 2 diffing mr_les.out.save with mr_les.out PASSED ============================================================== diffing mp_les.out.save with mp_les.out PASSED ============================================================== diffing evbout.save with evbout PASSED ============================================================== cd evb/malon_dbonds_umb_GAFF_MORSIFY_pimd_ld_full && ./Run.evb Running multisander version of sander amber10 Total processors = 2 Number of groups = 2 diffing mr_les.out.save with mr_les.out PASSED ============================================================== diffing mp_les.out.save with mp_les.out PASSED ============================================================== diffing evbout.save with evbout PASSED ============================================================== cd evb/malon_dbonds_umb_GAFF_MORSIFY_pimd_nhc_full && ./Run.evb Running multisander version of sander amber10 Total processors = 2 Number of groups = 2 diffing mr_les.out.save with mr_les.out PASSED ============================================================== diffing mp_les.out.save with mp_les.out PASSED ============================================================== diffing evbout.save with evbout PASSED ============================================================== cd evb/malon_dbonds_umb_GAFF_MORSIFY_XVDW && ./Run.evb Running multisander version of sander amber10 Total processors = 2 Number of groups = 2 diffing mr.out.save with mr.out PASSED ============================================================== diffing mp.out.save with mp.out PASSED ============================================================== diffing evbout.save with evbout PASSED ============================================================== cd evb/malon_dbonds_umb_GAFF_MORSIFY_XVDW_EXP-XCH && ./Run.evb Running multisander version of sander amber10 Total processors = 2 Number of groups = 2 diffing mr.out.save with mr.out PASSED ============================================================== diffing mp.out.save with mp.out PASSED ============================================================== diffing evbout.save with evbout PASSED ============================================================== cd evb/malon_dbonds_umb_GAFF_MORSIFY_XVDW_EXP-XCH_pimd_ld_full && ./Run.evb Running multisander version of sander amber10 Total processors = 2 Number of groups = 2 diffing mr_les.out.save with mr_les.out PASSED ============================================================== diffing mp_les.out.save with mp_les.out PASSED ============================================================== diffing evbout.save with evbout PASSED ============================================================== cd evb/malon_dbonds_umb_GAFF_MORSIFY_XVDW_EXP-XCH_pimd_nhc_full && ./Run.evb Running multisander version of sander amber10 Total processors = 2 Number of groups = 2 diffing mr_les.out.save with mr_les.out PASSED ============================================================== diffing mp_les.out.save with mp_les.out PASSED ============================================================== diffing evbout.save with evbout PASSED ============================================================== cd evb/malon_dbonds_umb_GAFF_MORSIFY_XVDW_EXP-XCH_nmpimd_full && ./Run.evb Running multisander version of sander amber10 Total processors = 2 Number of groups = 2 diffing mr_les.out.save with mr_les.out PASSED ============================================================== diffing mp_les.out.save with mp_les.out PASSED ============================================================== diffing evbout.save with evbout PASSED ============================================================== cd evb/malon_dbonds_umb_GAFF_MORSIFY_XVDW_GAUSS-XCH && ./Run.evb Running multisander version of sander amber10 Total processors = 2 Number of groups = 2 diffing mr.out.save with mr.out PASSED ============================================================== diffing mp.out.save with mp.out PASSED ============================================================== diffing evbout.save with evbout PASSED ============================================================== cd evb/malon_dbonds_umb_GAFF_MORSIFY_XVDW_GAUSS-XCH_pimd_ld_full && ./Run.evb Running multisander version of sander amber10 Total processors = 2 Number of groups = 2 diffing mr_les.out.save with mr_les.out PASSED ============================================================== diffing mp_les.out.save with mp_les.out PASSED ============================================================== diffing evbout.save with evbout PASSED ============================================================== cd evb/malon_dbonds_umb_GAFF_MORSIFY_XVDW_GAUSS-XCH_pimd_nhc_full && ./Run.evb Running multisander version of sander amber10 Total processors = 2 Number of groups = 2 diffing mr_les.out.save with mr_les.out PASSED ============================================================== diffing mp_les.out.save with mp_les.out PASSED ============================================================== diffing evbout.save with evbout PASSED ============================================================== cd evb/malon_dbonds_umb_GAFF_MORSIFY_XVDW_GAUSS-XCH_nmpimd_full && ./Run.evb Running multisander version of sander amber10 Total processors = 2 Number of groups = 2 diffing mr_les.out.save with mr_les.out PASSED ============================================================== diffing mp_les.out.save with mp_les.out PASSED ============================================================== diffing evbout.save with evbout PASSED ============================================================== cd evb/malon_emap_GAFF_MORSIFY && ./Run.evb Running multisander version of sander amber10 Total processors = 2 Number of groups = 2 diffing mr.out.save with mr.out PASSED ============================================================== diffing mp.out.save with mp.out PASSED ============================================================== diffing evbout.save with evbout PASSED ============================================================== cd evb/malon_emap_GAFF_MORSIFY_XVDW && ./Run.evb Running multisander version of sander amber10 Total processors = 2 Number of groups = 2 diffing mr.out.save with mr.out PASSED ============================================================== diffing mp.out.save with mp.out PASSED ============================================================== diffing evbout.save with evbout PASSED ============================================================== cd evb/malon_bond_umb_dg_UFF_3DG && ./Run.evb Running multisander version of sander amber10 Total processors = 2 Number of groups = 2 diffing mr.out.save with mr.out possible FAILURE: check mr.out.dif ============================================================== diffing mp.out.save with mp.out possible FAILURE: check mp.out.dif ============================================================== diffing evbout.save with evbout PASSED ============================================================== cd evb/malon_bond_umb_dg_UFF_3DG_nmpimd_full && ./Run.evb Running multisander version of sander amber10 Total processors = 2 Number of groups = 2 diffing mr_les.out.save with mr_les.out PASSED ============================================================== diffing mp_les.out.save with mp_les.out possible FAILURE: check mp_les.out.dif ============================================================== diffing evbout.save with evbout PASSED ============================================================== cd evb/malon_bond_umb_dg_UFF_3DG_pimd_ld_full && ./Run.evb Running multisander version of sander amber10 Total processors = 2 Number of groups = 2 diffing mr_les.out.save with mr_les.out PASSED ============================================================== diffing mp_les.out.save with mp_les.out PASSED ============================================================== diffing evbout.save with evbout PASSED ============================================================== cd evb/malon_bond_umb_dg_UFF_3DG_pimd_nhc_full && ./Run.evb Running multisander version of sander amber10 Total processors = 2 Number of groups = 2 diffing mr_les.out.save with mr_les.out possible FAILURE: check mr_les.out.dif ============================================================== diffing mp_les.out.save with mp_les.out possible FAILURE: check mp_les.out.dif ============================================================== diffing evbout.save with evbout PASSED ============================================================== cd evb/malon_bond_umb_dg_UFF_3DG_pimd_nhc_full_TI-MASS && ./Run.evb Running multisander version of sander amber10 Total processors = 2 Number of groups = 2 diffing mr_les-.8.out.save with mr_les-.8.out PASSED ============================================================== diffing mp_les-.8.out.save with mp_les-.8.out PASSED ============================================================== diffing evbout-.8.save with evbout-.8 PASSED ============================================================== Running multisander version of sander amber10 Total processors = 2 Number of groups = 2 diffing mr_les-.4.out.save with mr_les-.4.out PASSED ============================================================== diffing mp_les-.4.out.save with mp_les-.4.out PASSED ============================================================== diffing evbout-.4.save with evbout-.4 PASSED ============================================================== cd evb/malon_dbond_umb_dg_UFF_3DG_pimd_nhc_full_TI-MASS && ./Run.evb Running multisander version of sander amber10 Total processors = 2 Number of groups = 2 diffing mr_les-.8.out.save with mr_les-.8.out PASSED ============================================================== diffing mp_les-.8.out.save with mp_les-.8.out PASSED ============================================================== diffing evbout-.8.save with evbout-.8 possible FAILURE: check evbout-.8.dif ============================================================== Running multisander version of sander amber10 Total processors = 2 Number of groups = 2 diffing mr_les-.4.out.save with mr_les-.4.out PASSED ============================================================== diffing mp_les-.4.out.save with mp_les-.4.out PASSED ============================================================== diffing evbout-.4.save with evbout-.4 possible FAILURE: check evbout-.4.dif ============================================================== cd evb/malon_dbonds_umb_dg_UFF_3DG_qi_full_2D-PMF && ./Run.evb Running multisander version of sander amber10 Total processors = 2 Number of groups = 2 diffing mr_les.out.save with mr_les.out PASSED ============================================================== diffing mp_les.out.save with mp_les.out PASSED ============================================================== diffing evbout.save with evbout PASSED ============================================================== cd evb/malon_dbonds_umb_dg_UFF_3DG_qi_full_corrF && ./Run.evb Running multisander version of sander amber10 Total processors = 2 Number of groups = 2 diffing mr_les.out.save with mr_les.out PASSED ============================================================== diffing mp_les.out.save with mp_les.out PASSED ============================================================== diffing evbout.save with evbout PASSED ============================================================== cd evb/poh_dbonds_umb_dg_UFF_3DG && ./Run.evb Running multisander version of sander amber10 Total processors = 2 Number of groups = 2 diffing po.out.save with po.out PASSED ============================================================== diffing poh.out.save with poh.out PASSED ============================================================== diffing evbout.save with evbout PASSED ============================================================== cd evb/poh_dbonds_umb_dg_UFF_9DG && ./Run.evb Running multisander version of sander amber10 Total processors = 2 Number of groups = 2 rank 1 in job 989 node-06-01_44107 caused collective abort of all ranks exit status of rank 1: killed by signal 9 rank 0 in job 989 node-06-01_44107 caused collective abort of all ranks exit status of rank 0: killed by signal 9 ./Run.evb: Program error make: [test.sander.EVB] Error 1 (ignored) cd evb/poh_dbonds_umb_dg_UFF_9DG_pimd_ld_full && ./Run.evb Running multisander version of sander amber10 Total processors = 2 Number of groups = 2 rank 1 in job 990 node-06-01_44107 caused collective abort of all ranks exit status of rank 1: killed by signal 9 rank 0 in job 990 node-06-01_44107 caused collective abort of all ranks exit status of rank 0: killed by signal 9 ./Run.evb: Program error make: [test.sander.EVB] Error 1 (ignored) cd evb/poh_dbonds_umb_dg_UFF_9DG_pimd_nhc_full && ./Run.evb Running multisander version of sander amber10 Total processors = 2 Number of groups = 2 rank 1 in job 991 node-06-01_44107 caused collective abort of all ranks exit status of rank 1: killed by signal 9 ./Run.evb: Program error make: [test.sander.EVB] Error 1 (ignored) cd evb/poh_dbonds_umb_dg_UFF_9DG_nmpimd_full && ./Run.evb Running multisander version of sander amber10 Total processors = 2 Number of groups = 2 rank 1 in job 992 node-06-01_44107 caused collective abort of all ranks exit status of rank 1: killed by signal 9 ./Run.evb: Program error make: [test.sander.EVB] Error 1 (ignored) cd evb/poh_dbonds_umb_dg_UFF_9DG_nmpimd_full_TST-freqf && ./Run.evb Running multisander version of sander amber10 Total processors = 2 Number of groups = 2 rank 1 in job 993 node-06-01_44107 caused collective abort of all ranks exit status of rank 1: killed by signal 9 ./Run.evb: Program error make: [test.sander.EVB] Error 1 (ignored)