www.datacommons.psu.edu - /download/noid_lab/ykb5028/TMAO.urea/input/0.5_1/

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  6/6/2018  7:46 AM        13277 #mdrun.log.1#
  6/6/2018  7:46 AM        12897 #mdrun.log.2#
  6/6/2018  7:46 AM        12830 #mdrun.log.3#
  6/6/2018  7:46 AM        12991 #mdrun.log.4#
  6/6/2018  7:46 AM        12882 #mdrun.log.5#
  6/6/2018  7:46 AM          547 em.0.5_1.o2413902
  6/6/2018  7:46 AM       285814 em.confout.gro
  6/6/2018  7:46 AM       285796 em.gro
  6/6/2018  7:46 AM         2034 em.mdp
  6/6/2018  7:46 AM          308 em.top
  6/6/2018  7:46 AM         1250 force_types_Kast.itp
  6/6/2018  7:46 AM          671 force_types_urea.itp
  6/6/2018  7:46 AM         3555 grompp.log
  6/6/2018  7:46 AM       438214 md.0.5_1.confout.gro
  6/6/2018  7:46 AM       438251 md.0.5_1.gro
  6/6/2018  7:46 AM         3065 md.0.5_1.mdp
  6/6/2018  7:46 AM          547 md.0.5_1.o2424902
  6/6/2018  7:46 AM          308 md.0.5_1.top
  6/6/2018  7:46 AM        11693 mdout-em.mdp
  6/6/2018  7:46 AM        11749 mdout-md.0.5_1.mdp
  6/6/2018  7:46 AM        11750 mdout-npt.0.5_1.mdp
  6/6/2018  7:46 AM        11742 mdout-npt1.0.5_1.mdp
  6/6/2018  7:46 AM        11757 mdout-nvt.0.5_1.mdp
  6/6/2018  7:46 AM     10151527 mdrun.log
  6/6/2018  7:46 AM       438214 npt.0.5_1.confout.gro
  6/6/2018  7:46 AM       438251 npt.0.5_1.gro
  6/6/2018  7:46 AM         3064 npt.0.5_1.mdp
  6/6/2018  7:46 AM          547 npt.0.5_1.o2420133
  6/6/2018  7:46 AM          308 npt.0.5_1.top
  6/6/2018  7:46 AM       438214 npt1.0.5_1.confout.gro
  6/6/2018  7:46 AM       438214 npt1.0.5_1.gro
  6/6/2018  7:46 AM         2999 npt1.0.5_1.mdp
  6/6/2018  7:46 AM          547 npt1.0.5_1.o2419044
  6/6/2018  7:46 AM          308 npt1.0.5_1.top
  6/6/2018  7:46 AM       438214 nvt.0.5_1.confout.gro
  6/6/2018  7:46 AM       285814 nvt.0.5_1.gro
  6/6/2018  7:46 AM         2925 nvt.0.5_1.mdp
  6/6/2018  7:46 AM          547 nvt.0.5_1.o2413935
  6/6/2018  7:46 AM          547 nvt.0.5_1.o2416260
  6/6/2018  7:46 AM          308 nvt.0.5_1.top
  6/6/2018  7:46 AM        26086 pressafternpt.xvg
  6/6/2018  7:46 AM        96970 pressafternpt1.xvg
  6/6/2018  7:46 AM          235 qsub.sh
  6/6/2018  7:46 AM         1306 run_gmx.sh
  6/6/2018  7:46 AM       307376 state.cpt
  6/6/2018  7:46 AM       307376 state_prev.cpt
  6/6/2018  7:46 AM        <dir> surf
  6/6/2018  7:46 AM       200690 temp.xvg
  6/6/2018  7:46 AM         1017 tmao.1.gro
  6/6/2018  7:46 AM        12016 tmao.19.gro
  6/6/2018  7:46 AM         3990 tmao.Kast.itp
  6/6/2018  7:46 AM        26056 tmao19.urea39.gro
  6/6/2018  7:46 AM          400 urea.1.gro
  6/6/2018  7:46 AM         1214 urea.KBFF.itp
  6/6/2018  7:46 AM        25719 volumeafternpt.xvg
  6/6/2018  7:46 AM        95714 volumeafternpt1.xvg