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Type 'q()' to quit R. > > > source("groel_xrayPCA_tstates_WT.r") Attaching package: 'bio3d' The following object(s) are masked from package:base : identity segid chain resno resid eleno elety Stest "" "" "" "" "" "CA" Natom "7712" "7712" "7712" "7712" "7712" "1048" * Selected a total of: 1048 intersecting atoms * Loading required package: ncdf [1] "Reading file /net/gulrotkake/slars/groel_md/1XCK/116_1XCK_apo/results/traj_dimers/20-50ns_noWAT_1500frames_noH_chain_1.nc" [1] "Produced by program: sander" [1] "File conventions AMBER version 1.0" [1] "Frames: 1500" [1] "Atoms: 7712" [1] "Reading file /net/gulrotkake/slars/groel_md/1XCK/116_1XCK_apo/results/traj_dimers/20-50ns_noWAT_1500frames_noH_chain_2.nc" [1] "Produced by program: sander" [1] "File conventions AMBER version 1.0" [1] "Frames: 1500" [1] "Atoms: 7712" [1] "Reading file /net/gulrotkake/slars/groel_md/1XCK/116_1XCK_apo/results/traj_dimers/20-50ns_noWAT_1500frames_noH_chain_3.nc" [1] "Produced by program: sander" [1] "File conventions AMBER version 1.0" [1] "Frames: 1500" [1] "Atoms: 7712" [1] "Reading file /net/gulrotkake/slars/groel_md/1XCK/116_1XCK_apo/results/traj_dimers/20-50ns_noWAT_1500frames_noH_chain_4.nc" [1] "Produced by program: sander" [1] "File conventions AMBER version 1.0" [1] "Frames: 1500" [1] "Atoms: 7712" [1] "Reading file /net/gulrotkake/slars/groel_md/1XCK/116_1XCK_apo/results/traj_dimers/20-50ns_noWAT_1500frames_noH_chain_5.nc" [1] "Produced by program: sander" [1] "File conventions AMBER version 1.0" [1] "Frames: 1500" [1] "Atoms: 7712" [1] "Reading file /net/gulrotkake/slars/groel_md/1XCK/116_1XCK_apo/results/traj_dimers/20-50ns_noWAT_1500frames_noH_chain_6.nc" [1] "Produced by program: sander" [1] "File conventions AMBER version 1.0" [1] "Frames: 1500" [1] "Atoms: 7712" [1] "Reading file /net/gulrotkake/slars/groel_md/1XCK/116_1XCK_apo/results/traj_dimers/20-50ns_noWAT_1500frames_noH_chain_8.nc" [1] "Produced by program: sander" [1] "File conventions AMBER version 1.0" [1] "Frames: 1500" [1] "Atoms: 7712" [1] "Reading file /net/gulrotkake/slars/groel_md/1XCK/116_1XCK_apo/results/traj_dimers/20-50ns_noWAT_1500frames_noH_chain_9.nc" [1] "Produced by program: sander" [1] "File conventions AMBER version 1.0" [1] "Frames: 1500" [1] "Atoms: 7712" [1] "Reading file /net/gulrotkake/slars/groel_md/1XCK/116_1XCK_apo/results/traj_dimers/20-50ns_noWAT_1500frames_noH_chain_10.nc" [1] "Produced by program: sander" [1] "File conventions AMBER version 1.0" [1] "Frames: 1500" [1] "Atoms: 7712" [1] "Reading file /net/gulrotkake/slars/groel_md/1XCK/116_1XCK_apo/results/traj_dimers/20-50ns_noWAT_1500frames_noH_chain_11.nc" [1] "Produced by program: sander" [1] "File conventions AMBER version 1.0" [1] "Frames: 1500" [1] "Atoms: 7712" [1] "Reading file /net/gulrotkake/slars/groel_md/1XCK/116_1XCK_apo/results/traj_dimers/20-50ns_noWAT_1500frames_noH_chain_12.nc" [1] "Produced by program: sander" [1] "File conventions AMBER version 1.0" [1] "Frames: 1500" [1] "Atoms: 7712" [1] "Reading file /net/gulrotkake/slars/groel_md/1XCK/116_1XCK_apo/results/traj_dimers/20-50ns_noWAT_1500frames_noH_chain_13.nc" [1] "Produced by program: sander" [1] "File conventions AMBER version 1.0" [1] "Frames: 1500" [1] "Atoms: 7712" [1] "Reading file /net/gulrotkake/slars/groel_md/1XCK/129_1XCK_MGATP/results/traj_dimers/20-50ns_noWAT_1500frames_noATP_noH_chain_1.nc" [1] "Produced by program: sander" [1] "File conventions AMBER version 1.0" [1] "Frames: 1500" [1] "Atoms: 7712" [1] "Reading file /net/gulrotkake/slars/groel_md/1XCK/129_1XCK_MGATP/results/traj_dimers/20-50ns_noWAT_1500frames_noATP_noH_chain_2.nc" [1] "Produced by program: sander" [1] "File conventions AMBER version 1.0" [1] "Frames: 1500" [1] "Atoms: 7712" [1] "Reading file /net/gulrotkake/slars/groel_md/1XCK/129_1XCK_MGATP/results/traj_dimers/20-50ns_noWAT_1500frames_noATP_noH_chain_3.nc" [1] "Produced by program: sander" [1] "File conventions AMBER version 1.0" [1] "Frames: 1500" [1] "Atoms: 7712" [1] "Reading file /net/gulrotkake/slars/groel_md/1XCK/129_1XCK_MGATP/results/traj_dimers/20-50ns_noWAT_1500frames_noATP_noH_chain_4.nc" [1] "Produced by program: sander" [1] "File conventions AMBER version 1.0" [1] "Frames: 1500" [1] "Atoms: 7712" [1] "Reading file /net/gulrotkake/slars/groel_md/1XCK/129_1XCK_MGATP/results/traj_dimers/20-50ns_noWAT_1500frames_noATP_noH_chain_5.nc" [1] "Produced by program: sander" [1] "File conventions AMBER version 1.0" [1] "Frames: 1500" [1] "Atoms: 7712" [1] "Reading file /net/gulrotkake/slars/groel_md/1XCK/129_1XCK_MGATP/results/traj_dimers/20-50ns_noWAT_1500frames_noATP_noH_chain_6.nc" [1] "Produced by program: sander" [1] "File conventions AMBER version 1.0" [1] "Frames: 1500" [1] "Atoms: 7712" [1] "Reading file /net/gulrotkake/slars/groel_md/1XCK/129_1XCK_MGATP/results/traj_dimers/20-50ns_noWAT_1500frames_noATP_noH_chain_8.nc" [1] "Produced by program: sander" [1] "File conventions AMBER version 1.0" [1] "Frames: 1500" [1] "Atoms: 7712" [1] "Reading file /net/gulrotkake/slars/groel_md/1XCK/129_1XCK_MGATP/results/traj_dimers/20-50ns_noWAT_1500frames_noATP_noH_chain_9.nc" [1] "Produced by program: sander" [1] "File conventions AMBER version 1.0" [1] "Frames: 1500" [1] "Atoms: 7712" [1] "Reading file /net/gulrotkake/slars/groel_md/1XCK/129_1XCK_MGATP/results/traj_dimers/20-50ns_noWAT_1500frames_noATP_noH_chain_10.nc" [1] "Produced by program: sander" [1] "File conventions AMBER version 1.0" [1] "Frames: 1500" [1] "Atoms: 7712" [1] "Reading file /net/gulrotkake/slars/groel_md/1XCK/129_1XCK_MGATP/results/traj_dimers/20-50ns_noWAT_1500frames_noATP_noH_chain_11.nc" [1] "Produced by program: sander" [1] "File conventions AMBER version 1.0" [1] "Frames: 1500" [1] "Atoms: 7712" [1] "Reading file /net/gulrotkake/slars/groel_md/1XCK/129_1XCK_MGATP/results/traj_dimers/20-50ns_noWAT_1500frames_noATP_noH_chain_12.nc" [1] "Produced by program: sander" [1] "File conventions AMBER version 1.0" [1] "Frames: 1500" [1] "Atoms: 7712" [1] "Reading file /net/gulrotkake/slars/groel_md/1XCK/129_1XCK_MGATP/results/traj_dimers/20-50ns_noWAT_1500frames_noATP_noH_chain_13.nc" [1] "Produced by program: sander" [1] "File conventions AMBER version 1.0" [1] "Frames: 1500" [1] "Atoms: 7712" [1] "Reading file /net/lutefisk/slars/groel_md/1XCK/129_1XCK_MGATP_temp350/results/traj_dimers/50-90ns_noWAT_1000frames_noATP_noH_chain_1.nc" [1] "Produced by program: sander" [1] "File conventions AMBER version 1.0" [1] "Frames: 1000" [1] "Atoms: 7712" [1] "Reading file /net/lutefisk/slars/groel_md/1XCK/129_1XCK_MGATP_temp350/results/traj_dimers/50-90ns_noWAT_1000frames_noATP_noH_chain_2.nc" [1] "Produced by program: sander" [1] "File conventions AMBER version 1.0" [1] "Frames: 1000" [1] "Atoms: 7712" [1] "Reading file /net/lutefisk/slars/groel_md/1XCK/129_1XCK_MGATP_temp350/results/traj_dimers/50-90ns_noWAT_1000frames_noATP_noH_chain_3.nc" [1] "Produced by program: sander" [1] "File conventions AMBER version 1.0" [1] "Frames: 1000" [1] "Atoms: 7712" [1] "Reading file /net/lutefisk/slars/groel_md/1XCK/129_1XCK_MGATP_temp350/results/traj_dimers/50-90ns_noWAT_1000frames_noATP_noH_chain_4.nc" [1] "Produced by program: sander" [1] "File conventions AMBER version 1.0" [1] "Frames: 1000" [1] "Atoms: 7712" [1] "Reading file /net/lutefisk/slars/groel_md/1XCK/129_1XCK_MGATP_temp350/results/traj_dimers/50-90ns_noWAT_1000frames_noATP_noH_chain_5.nc" [1] "Produced by program: sander" [1] "File conventions AMBER version 1.0" [1] "Frames: 1000" [1] "Atoms: 7712" [1] "Reading file /net/lutefisk/slars/groel_md/1XCK/129_1XCK_MGATP_temp350/results/traj_dimers/50-90ns_noWAT_1000frames_noATP_noH_chain_6.nc" [1] "Produced by program: sander" [1] "File conventions AMBER version 1.0" [1] "Frames: 1000" [1] "Atoms: 7712" [1] "Reading file /net/lutefisk/slars/groel_md/1XCK/129_1XCK_MGATP_temp350/results/traj_dimers/50-90ns_noWAT_1000frames_noATP_noH_chain_8.nc" [1] "Produced by program: sander" [1] "File conventions AMBER version 1.0" [1] "Frames: 1000" [1] "Atoms: 7712" [1] "Reading file /net/lutefisk/slars/groel_md/1XCK/129_1XCK_MGATP_temp350/results/traj_dimers/50-90ns_noWAT_1000frames_noATP_noH_chain_9.nc" [1] "Produced by program: sander" [1] "File conventions AMBER version 1.0" [1] "Frames: 1000" [1] "Atoms: 7712" [1] "Reading file /net/lutefisk/slars/groel_md/1XCK/129_1XCK_MGATP_temp350/results/traj_dimers/50-90ns_noWAT_1000frames_noATP_noH_chain_10.nc" [1] "Produced by program: sander" [1] "File conventions AMBER version 1.0" [1] "Frames: 1000" [1] "Atoms: 7712" [1] "Reading file /net/lutefisk/slars/groel_md/1XCK/129_1XCK_MGATP_temp350/results/traj_dimers/50-90ns_noWAT_1000frames_noATP_noH_chain_11.nc" [1] "Produced by program: sander" [1] "File conventions AMBER version 1.0" [1] "Frames: 1000" [1] "Atoms: 7712" [1] "Reading file /net/lutefisk/slars/groel_md/1XCK/129_1XCK_MGATP_temp350/results/traj_dimers/50-90ns_noWAT_1000frames_noATP_noH_chain_12.nc" [1] "Produced by program: sander" [1] "File conventions AMBER version 1.0" [1] "Frames: 1000" [1] "Atoms: 7712" [1] "Reading file /net/lutefisk/slars/groel_md/1XCK/129_1XCK_MGATP_temp350/results/traj_dimers/50-90ns_noWAT_1000frames_noATP_noH_chain_13.nc" [1] "Produced by program: sander" [1] "File conventions AMBER version 1.0" [1] "Frames: 1000" [1] "Atoms: 7712" > source("groel_xrayPCA_tstates_mutants.r") Loading required package: foreign Loading required package: sp Loading required package: lattice Note: polygon geometry computations in maptools depend on the package gpclib, which has a restricted licence. It is disabled by default; to enable gpclib, type gpclibPermit() Checking rgeos availability as gpclib substitute: FALSE segid chain resno resid eleno elety Stest "" "" "" "" "" "CA" Natom "7712" "7712" "7712" "7712" "7712" "1048" * Selected a total of: 1048 intersecting atoms * [1] "Reading file /net/lutefisk/slars/groel_md/mutants/162_E434K_MGATP/results/traj_dimers/20-50ns_noWAT_1500frames_noH_chain_1.nc" [1] "Produced by program: sander" [1] "File conventions AMBER version 1.0" [1] "Frames: 1500" [1] "Atoms: 7712" [1] "Reading file /net/lutefisk/slars/groel_md/mutants/162_E434K_MGATP/results/traj_dimers/20-50ns_noWAT_1500frames_noH_chain_2.nc" [1] "Produced by program: sander" [1] "File conventions AMBER version 1.0" [1] "Frames: 1500" [1] "Atoms: 7712" [1] "Reading file /net/lutefisk/slars/groel_md/mutants/162_E434K_MGATP/results/traj_dimers/20-50ns_noWAT_1500frames_noH_chain_3.nc" [1] "Produced by program: sander" [1] "File conventions AMBER version 1.0" [1] "Frames: 1500" [1] "Atoms: 7712" [1] "Reading file /net/lutefisk/slars/groel_md/mutants/162_E434K_MGATP/results/traj_dimers/20-50ns_noWAT_1500frames_noH_chain_4.nc" [1] "Produced by program: sander" [1] "File conventions AMBER version 1.0" [1] "Frames: 1500" [1] "Atoms: 7712" [1] "Reading file /net/lutefisk/slars/groel_md/mutants/162_E434K_MGATP/results/traj_dimers/20-50ns_noWAT_1500frames_noH_chain_5.nc" [1] "Produced by program: sander" [1] "File conventions AMBER version 1.0" [1] "Frames: 1500" [1] "Atoms: 7712" [1] "Reading file /net/lutefisk/slars/groel_md/mutants/162_E434K_MGATP/results/traj_dimers/20-50ns_noWAT_1500frames_noH_chain_6.nc" [1] "Produced by program: sander" [1] "File conventions AMBER version 1.0" [1] "Frames: 1500" [1] "Atoms: 7712" [1] "Reading file /net/lutefisk/slars/groel_md/mutants/162_E434K_MGATP/results/traj_dimers/20-50ns_noWAT_1500frames_noH_chain_8.nc" [1] "Produced by program: sander" [1] "File conventions AMBER version 1.0" [1] "Frames: 1500" [1] "Atoms: 7712" [1] "Reading file /net/lutefisk/slars/groel_md/mutants/162_E434K_MGATP/results/traj_dimers/20-50ns_noWAT_1500frames_noH_chain_9.nc" [1] "Produced by program: sander" [1] "File conventions AMBER version 1.0" [1] "Frames: 1500" [1] "Atoms: 7712" [1] "Reading file /net/lutefisk/slars/groel_md/mutants/162_E434K_MGATP/results/traj_dimers/20-50ns_noWAT_1500frames_noH_chain_10.nc" [1] "Produced by program: sander" [1] "File conventions AMBER version 1.0" [1] "Frames: 1500" [1] "Atoms: 7712" [1] "Reading file /net/lutefisk/slars/groel_md/mutants/162_E434K_MGATP/results/traj_dimers/20-50ns_noWAT_1500frames_noH_chain_11.nc" [1] "Produced by program: sander" [1] "File conventions AMBER version 1.0" [1] "Frames: 1500" [1] "Atoms: 7712" [1] "Reading file /net/lutefisk/slars/groel_md/mutants/162_E434K_MGATP/results/traj_dimers/20-50ns_noWAT_1500frames_noH_chain_12.nc" [1] "Produced by program: sander" [1] "File conventions AMBER version 1.0" [1] "Frames: 1500" [1] "Atoms: 7712" [1] "Reading file /net/lutefisk/slars/groel_md/mutants/162_E434K_MGATP/results/traj_dimers/20-50ns_noWAT_1500frames_noH_chain_13.nc" [1] "Produced by program: sander" [1] "File conventions AMBER version 1.0" [1] "Frames: 1500" [1] "Atoms: 7712" > source("groel_xrayPCA_tstates_1XCK-E434K.r") segid chain resno resid eleno elety Stest "" "" "" "" "" "CA" Natom "7712" "7712" "7712" "7712" "7712" "1048" * Selected a total of: 1048 intersecting atoms * [1] "Reading file /net/lutefisk/slars/groel_md/1XCK/191_1XCK_E434K/results/traj_dimers/20-50ns_noWAT_1500frames_noATP_noH_chain_1.nc" [1] "Produced by program: sander" [1] "File conventions AMBER version 1.0" [1] "Frames: 1500" [1] "Atoms: 7712" [1] "Reading file /net/lutefisk/slars/groel_md/1XCK/191_1XCK_E434K/results/traj_dimers/20-50ns_noWAT_1500frames_noATP_noH_chain_2.nc" [1] "Produced by program: sander" [1] "File conventions AMBER version 1.0" [1] "Frames: 1500" [1] "Atoms: 7712" [1] "Reading file /net/lutefisk/slars/groel_md/1XCK/191_1XCK_E434K/results/traj_dimers/20-50ns_noWAT_1500frames_noATP_noH_chain_3.nc" [1] "Produced by program: sander" [1] "File conventions AMBER version 1.0" [1] "Frames: 1500" [1] "Atoms: 7712" [1] "Reading file /net/lutefisk/slars/groel_md/1XCK/191_1XCK_E434K/results/traj_dimers/20-50ns_noWAT_1500frames_noATP_noH_chain_4.nc" [1] "Produced by program: sander" [1] "File conventions AMBER version 1.0" [1] "Frames: 1500" [1] "Atoms: 7712" [1] "Reading file /net/lutefisk/slars/groel_md/1XCK/191_1XCK_E434K/results/traj_dimers/20-50ns_noWAT_1500frames_noATP_noH_chain_5.nc" [1] "Produced by program: sander" [1] "File conventions AMBER version 1.0" [1] "Frames: 1500" [1] "Atoms: 7712" [1] "Reading file /net/lutefisk/slars/groel_md/1XCK/191_1XCK_E434K/results/traj_dimers/20-50ns_noWAT_1500frames_noATP_noH_chain_6.nc" [1] "Produced by program: sander" [1] "File conventions AMBER version 1.0" [1] "Frames: 1500" [1] "Atoms: 7712" [1] "Reading file /net/lutefisk/slars/groel_md/1XCK/191_1XCK_E434K/results/traj_dimers/20-50ns_noWAT_1500frames_noATP_noH_chain_8.nc" [1] "Produced by program: sander" [1] "File conventions AMBER version 1.0" [1] "Frames: 1500" [1] "Atoms: 7712" [1] "Reading file /net/lutefisk/slars/groel_md/1XCK/191_1XCK_E434K/results/traj_dimers/20-50ns_noWAT_1500frames_noATP_noH_chain_9.nc" [1] "Produced by program: sander" [1] "File conventions AMBER version 1.0" [1] "Frames: 1500" [1] "Atoms: 7712" [1] "Reading file /net/lutefisk/slars/groel_md/1XCK/191_1XCK_E434K/results/traj_dimers/20-50ns_noWAT_1500frames_noATP_noH_chain_10.nc" [1] "Produced by program: sander" [1] "File conventions AMBER version 1.0" [1] "Frames: 1500" [1] "Atoms: 7712" [1] "Reading file /net/lutefisk/slars/groel_md/1XCK/191_1XCK_E434K/results/traj_dimers/20-50ns_noWAT_1500frames_noATP_noH_chain_11.nc" [1] "Produced by program: sander" [1] "File conventions AMBER version 1.0" [1] "Frames: 1500" [1] "Atoms: 7712" [1] "Reading file /net/lutefisk/slars/groel_md/1XCK/191_1XCK_E434K/results/traj_dimers/20-50ns_noWAT_1500frames_noATP_noH_chain_12.nc" [1] "Produced by program: sander" [1] "File conventions AMBER version 1.0" [1] "Frames: 1500" [1] "Atoms: 7712" [1] "Reading file /net/lutefisk/slars/groel_md/1XCK/191_1XCK_E434K/results/traj_dimers/20-50ns_noWAT_1500frames_noATP_noH_chain_13.nc" [1] "Produced by program: sander" [1] "File conventions AMBER version 1.0" [1] "Frames: 1500" [1] "Atoms: 7712" > source("groel_xrayPCA_tstates_1XCK-rhodanese.r") segid chain resno resid eleno elety Stest "" "" "" "" "" "CA" Natom "7712" "7712" "7712" "7712" "7712" "1048" * Selected a total of: 1048 intersecting atoms * [1] "Reading file /net/lutefisk/slars/groel_md/1XCK_rhodanese/171_1XCK_rhodanese_ATP/results/traj_dimers/20-50ns_noWAT_1500frames_noATP_noH_chain_1.nc" [1] "Produced by program: sander" [1] "File conventions AMBER version 1.0" [1] "Frames: 1500" [1] "Atoms: 7712" [1] "Reading file /net/lutefisk/slars/groel_md/1XCK_rhodanese/171_1XCK_rhodanese_ATP/results/traj_dimers/20-50ns_noWAT_1500frames_noATP_noH_chain_2.nc" [1] "Produced by program: sander" [1] "File conventions AMBER version 1.0" [1] "Frames: 1500" [1] "Atoms: 7712" [1] "Reading file /net/lutefisk/slars/groel_md/1XCK_rhodanese/171_1XCK_rhodanese_ATP/results/traj_dimers/20-50ns_noWAT_1500frames_noATP_noH_chain_3.nc" [1] "Produced by program: sander" [1] "File conventions AMBER version 1.0" [1] "Frames: 1500" [1] "Atoms: 7712" [1] "Reading file /net/lutefisk/slars/groel_md/1XCK_rhodanese/171_1XCK_rhodanese_ATP/results/traj_dimers/20-50ns_noWAT_1500frames_noATP_noH_chain_4.nc" [1] "Produced by program: sander" [1] "File conventions AMBER version 1.0" [1] "Frames: 1500" [1] "Atoms: 7712" [1] "Reading file /net/lutefisk/slars/groel_md/1XCK_rhodanese/171_1XCK_rhodanese_ATP/results/traj_dimers/20-50ns_noWAT_1500frames_noATP_noH_chain_5.nc" [1] "Produced by program: sander" [1] "File conventions AMBER version 1.0" [1] "Frames: 1500" [1] "Atoms: 7712" [1] "Reading file /net/lutefisk/slars/groel_md/1XCK_rhodanese/171_1XCK_rhodanese_ATP/results/traj_dimers/20-50ns_noWAT_1500frames_noATP_noH_chain_6.nc" [1] "Produced by program: sander" [1] "File conventions AMBER version 1.0" [1] "Frames: 1500" [1] "Atoms: 7712" [1] "Reading file /net/lutefisk/slars/groel_md/1XCK_rhodanese/171_1XCK_rhodanese_ATP/results/traj_dimers/20-50ns_noWAT_1500frames_noATP_noH_chain_8.nc" [1] "Produced by program: sander" [1] "File conventions AMBER version 1.0" [1] "Frames: 1500" [1] "Atoms: 7712" [1] "Reading file /net/lutefisk/slars/groel_md/1XCK_rhodanese/171_1XCK_rhodanese_ATP/results/traj_dimers/20-50ns_noWAT_1500frames_noATP_noH_chain_9.nc" [1] "Produced by program: sander" [1] "File conventions AMBER version 1.0" [1] "Frames: 1500" [1] "Atoms: 7712" [1] "Reading file /net/lutefisk/slars/groel_md/1XCK_rhodanese/171_1XCK_rhodanese_ATP/results/traj_dimers/20-50ns_noWAT_1500frames_noATP_noH_chain_10.nc" [1] "Produced by program: sander" [1] "File conventions AMBER version 1.0" [1] "Frames: 1500" [1] "Atoms: 7712" [1] "Reading file /net/lutefisk/slars/groel_md/1XCK_rhodanese/171_1XCK_rhodanese_ATP/results/traj_dimers/20-50ns_noWAT_1500frames_noATP_noH_chain_11.nc" [1] "Produced by program: sander" [1] "File conventions AMBER version 1.0" [1] "Frames: 1500" [1] "Atoms: 7712" [1] "Reading file /net/lutefisk/slars/groel_md/1XCK_rhodanese/171_1XCK_rhodanese_ATP/results/traj_dimers/20-50ns_noWAT_1500frames_noATP_noH_chain_12.nc" [1] "Produced by program: sander" [1] "File conventions AMBER version 1.0" [1] "Frames: 1500" [1] "Atoms: 7712" [1] "Reading file /net/lutefisk/slars/groel_md/1XCK_rhodanese/171_1XCK_rhodanese_ATP/results/traj_dimers/20-50ns_noWAT_1500frames_noATP_noH_chain_13.nc" [1] "Produced by program: sander" [1] "File conventions AMBER version 1.0" [1] "Frames: 1500" [1] "Atoms: 7712" > > source("combo_confplot.r") KernSmooth 2.23 loaded Copyright M. P. Wand 1997-2009 >