UNRES-Dock example output
authorCezary Czaplewski <czarek@chem.univ.gda.pl>
Sun, 1 Mar 2020 07:50:56 +0000 (08:50 +0100)
committerCezary Czaplewski <czarek@chem.univ.gda.pl>
Sun, 1 Mar 2020 07:50:56 +0000 (08:50 +0100)
commit018446aca1e32faf80f41e818acbfc61e5d872c9
tree0375cef928deb819f9fc2686fcddabb4df812e44
parent88d4f45c783f3644ff7ae49572b7b609ef3c9617
UNRES-Dock example output
120 files changed:
examples/UNRES-Dock/cluster2allatom.csh
examples/UNRES-Dock/output/1UDI_A.pdb [new file with mode: 0644]
examples/UNRES-Dock/output/1UDI_B.pdb [new file with mode: 0644]
examples/UNRES-Dock/output/README [new file with mode: 0644]
examples/UNRES-Dock/output/boxsize.txt [new file with mode: 0644]
examples/UNRES-Dock/output/cluster.inp [new file with mode: 0644]
examples/UNRES-Dock/output/cluster2allatom.csh [new file with mode: 0755]
examples/UNRES-Dock/output/cluster_example.inp [new file with mode: 0644]
examples/UNRES-Dock/output/dimer.tex [new file with mode: 0644]
examples/UNRES-Dock/output/dimer_clust.out_000 [new file with mode: 0644]
examples/UNRES-Dock/output/log [new file with mode: 0644]
examples/UNRES-Dock/output/model01.pdb [new file with mode: 0644]
examples/UNRES-Dock/output/model02.pdb [new file with mode: 0644]
examples/UNRES-Dock/output/model03.pdb [new file with mode: 0644]
examples/UNRES-Dock/output/model04.pdb [new file with mode: 0644]
examples/UNRES-Dock/output/model05.pdb [new file with mode: 0644]
examples/UNRES-Dock/output/model06.pdb [new file with mode: 0644]
examples/UNRES-Dock/output/model07.pdb [new file with mode: 0644]
examples/UNRES-Dock/output/model08.pdb [new file with mode: 0644]
examples/UNRES-Dock/output/model09.pdb [new file with mode: 0644]
examples/UNRES-Dock/output/model10.pdb [new file with mode: 0644]
examples/UNRES-Dock/output/model11.pdb [new file with mode: 0644]
examples/UNRES-Dock/output/model12.pdb [new file with mode: 0644]
examples/UNRES-Dock/output/model13.pdb [new file with mode: 0644]
examples/UNRES-Dock/output/model14.pdb [new file with mode: 0644]
examples/UNRES-Dock/output/model15.pdb [new file with mode: 0644]
examples/UNRES-Dock/output/model16.pdb [new file with mode: 0644]
examples/UNRES-Dock/output/model17.pdb [new file with mode: 0644]
examples/UNRES-Dock/output/model18.pdb [new file with mode: 0644]
examples/UNRES-Dock/output/model19.pdb [new file with mode: 0644]
examples/UNRES-Dock/output/model20.pdb [new file with mode: 0644]
examples/UNRES-Dock/output/model21.pdb [new file with mode: 0644]
examples/UNRES-Dock/output/model22.pdb [new file with mode: 0644]
examples/UNRES-Dock/output/model23.pdb [new file with mode: 0644]
examples/UNRES-Dock/output/model24.pdb [new file with mode: 0644]
examples/UNRES-Dock/output/prepare_all.csh [new file with mode: 0755]
examples/UNRES-Dock/output/reference.pdb [new file with mode: 0644]
examples/UNRES-Dock/output/seq [new file with mode: 0644]
examples/UNRES-Dock/output/start_cluster.mat [new file with mode: 0644]
examples/UNRES-Dock/output/start_cluster_example.mat [new file with mode: 0644]
examples/UNRES-Dock/output/start_unres.mat [new file with mode: 0644]
examples/UNRES-Dock/output/start_unres_example.mat [new file with mode: 0644]
examples/UNRES-Dock/output/start_wham.mat [new file with mode: 0644]
examples/UNRES-Dock/output/start_wham_example.mat [new file with mode: 0644]
examples/UNRES-Dock/output/structure1.pdb [new file with mode: 0644]
examples/UNRES-Dock/output/structure10.pdb [new file with mode: 0644]
examples/UNRES-Dock/output/structure2.pdb [new file with mode: 0644]
examples/UNRES-Dock/output/structure3.pdb [new file with mode: 0644]
examples/UNRES-Dock/output/structure4.pdb [new file with mode: 0644]
examples/UNRES-Dock/output/structure5.pdb [new file with mode: 0644]
examples/UNRES-Dock/output/structure6.pdb [new file with mode: 0644]
examples/UNRES-Dock/output/structure7.pdb [new file with mode: 0644]
examples/UNRES-Dock/output/structure8.pdb [new file with mode: 0644]
examples/UNRES-Dock/output/structure9.pdb [new file with mode: 0644]
examples/UNRES-Dock/output/template01.sco [new file with mode: 0644]
examples/UNRES-Dock/output/template02.sco [new file with mode: 0644]
examples/UNRES-Dock/output/template03.sco [new file with mode: 0644]
examples/UNRES-Dock/output/template04.sco [new file with mode: 0644]
examples/UNRES-Dock/output/template05.sco [new file with mode: 0644]
examples/UNRES-Dock/output/template06.sco [new file with mode: 0644]
examples/UNRES-Dock/output/template07.sco [new file with mode: 0644]
examples/UNRES-Dock/output/template08.sco [new file with mode: 0644]
examples/UNRES-Dock/output/template09.sco [new file with mode: 0644]
examples/UNRES-Dock/output/template10.sco [new file with mode: 0644]
examples/UNRES-Dock/output/template11.sco [new file with mode: 0644]
examples/UNRES-Dock/output/template12.sco [new file with mode: 0644]
examples/UNRES-Dock/output/template13.sco [new file with mode: 0644]
examples/UNRES-Dock/output/template14.sco [new file with mode: 0644]
examples/UNRES-Dock/output/template15.sco [new file with mode: 0644]
examples/UNRES-Dock/output/template16.sco [new file with mode: 0644]
examples/UNRES-Dock/output/template17.sco [new file with mode: 0644]
examples/UNRES-Dock/output/template18.sco [new file with mode: 0644]
examples/UNRES-Dock/output/template19.sco [new file with mode: 0644]
examples/UNRES-Dock/output/template20.sco [new file with mode: 0644]
examples/UNRES-Dock/output/template21.sco [new file with mode: 0644]
examples/UNRES-Dock/output/template22.sco [new file with mode: 0644]
examples/UNRES-Dock/output/template23.sco [new file with mode: 0644]
examples/UNRES-Dock/output/template24.sco [new file with mode: 0644]
examples/UNRES-Dock/output/unres_dock.inp [new file with mode: 0644]
examples/UNRES-Dock/output/unres_dock.out_GB000 [new file with mode: 0644]
examples/UNRES-Dock/output/unres_dock_GB000.stat [new file with mode: 0644]
examples/UNRES-Dock/output/unres_dock_GB001.stat [new file with mode: 0644]
examples/UNRES-Dock/output/unres_dock_GB002.stat [new file with mode: 0644]
examples/UNRES-Dock/output/unres_dock_GB003.stat [new file with mode: 0644]
examples/UNRES-Dock/output/unres_dock_GB004.stat [new file with mode: 0644]
examples/UNRES-Dock/output/unres_dock_GB005.stat [new file with mode: 0644]
examples/UNRES-Dock/output/unres_dock_GB006.stat [new file with mode: 0644]
examples/UNRES-Dock/output/unres_dock_GB007.stat [new file with mode: 0644]
examples/UNRES-Dock/output/unres_dock_GB008.stat [new file with mode: 0644]
examples/UNRES-Dock/output/unres_dock_GB009.stat [new file with mode: 0644]
examples/UNRES-Dock/output/unres_dock_GB010.stat [new file with mode: 0644]
examples/UNRES-Dock/output/unres_dock_GB011.stat [new file with mode: 0644]
examples/UNRES-Dock/output/unres_dock_GB012.stat [new file with mode: 0644]
examples/UNRES-Dock/output/unres_dock_GB013.stat [new file with mode: 0644]
examples/UNRES-Dock/output/unres_dock_GB014.stat [new file with mode: 0644]
examples/UNRES-Dock/output/unres_dock_GB015.stat [new file with mode: 0644]
examples/UNRES-Dock/output/unres_dock_MD000.cx [new file with mode: 0644]
examples/UNRES-Dock/output/unres_dock_mremd.rst [new file with mode: 0644]
examples/UNRES-Dock/output/unres_example.inp [new file with mode: 0644]
examples/UNRES-Dock/output/wham.cx [new file with mode: 0644]
examples/UNRES-Dock/output/wham.inp [new file with mode: 0644]
examples/UNRES-Dock/output/wham.out_GB000 [new file with mode: 0644]
examples/UNRES-Dock/output/wham.thermal [new file with mode: 0644]
examples/UNRES-Dock/output/wham_T300K.x [new file with mode: 0644]
examples/UNRES-Dock/output/wham_T300K_0001.pdb [new file with mode: 0644]
examples/UNRES-Dock/output/wham_T300K_0002.pdb [new file with mode: 0644]
examples/UNRES-Dock/output/wham_T300K_0003.pdb [new file with mode: 0644]
examples/UNRES-Dock/output/wham_T300K_0004.pdb [new file with mode: 0644]
examples/UNRES-Dock/output/wham_T300K_0005.pdb [new file with mode: 0644]
examples/UNRES-Dock/output/wham_T300K_0006.pdb [new file with mode: 0644]
examples/UNRES-Dock/output/wham_T300K_0007.pdb [new file with mode: 0644]
examples/UNRES-Dock/output/wham_T300K_0008.pdb [new file with mode: 0644]
examples/UNRES-Dock/output/wham_T300K_0009.pdb [new file with mode: 0644]
examples/UNRES-Dock/output/wham_T300K_0010.pdb [new file with mode: 0644]
examples/UNRES-Dock/output/wham_T300K_ave.pdb [new file with mode: 0644]
examples/UNRES-Dock/output/wham_example.inp [new file with mode: 0644]
examples/UNRES-Dock/prepare_all.csh
examples/UNRES-Dock/start_unres_example.mat
examples/UNRES-Dock/unres_example.inp
examples/UNRES-Dock/wham_example.inp