mmka.chem.univ.gda.pl Git - unres.git/commit

author	Dawid Jagiela <lightnir@chem.univ.gda.pl>
	Thu, 10 May 2012 14:09:59 +0000 (16:09 +0200)
committer	Dawid Jagiela <lightnir@chem.univ.gda.pl>
	Thu, 10 May 2012 14:09:59 +0000 (16:09 +0200)
commit	43fd38cadfbe4659305fdd450cb851601dd6654c
tree	bdb8aebcb4d183d2726868d02d03a5e4304a65e5	tree \| snapshot
parent	55d75fc5211f284fc032dbb7fbb0fb6eff427a10	commit \| diff

- added UNRES Multichain examples
- CMake for src_MIN
- junkfiles cleanup

46 files changed:

CMakeLists.txt		diff \| blob \| history
examples/unres/MD/Multichain/1DKZ-gab-ber.inp	[new file with mode: 0644]	blob
examples/unres/MD/Multichain/1DKZ-gab-ber.intin	[new file with mode: 0644]	blob
examples/unres/MD/Multichain/1DKZ-gab-ber.out_GB000	[new file with mode: 0644]	blob
examples/unres/MD/Multichain/1DKZ-gab-ber_000.rst	[new file with mode: 0644]	blob
examples/unres/MD/Multichain/1DKZ-gab-ber_GB000.int	[new file with mode: 0644]	blob
examples/unres/MD/Multichain/1DKZ-gab-ber_GB000.mol2	[new file with mode: 0644]	blob
examples/unres/MD/Multichain/1DKZ-gab-ber_GB000.pdb	[new file with mode: 0644]	blob
examples/unres/MD/Multichain/1DKZ-gab-ber_GB000.stat	[new file with mode: 0644]	blob
examples/unres/MD/Multichain/1DKZ-gab-ber_MD000.pdb	[new file with mode: 0644]	blob
examples/unres/MD/Multichain/1DKZ-gab-ene.inp	[new file with mode: 0644]	blob
examples/unres/MD/Multichain/1DKZ-gab-ene.intin	[new file with mode: 0644]	blob
examples/unres/MD/Multichain/1DKZ-gab-ene.out_GB000	[new file with mode: 0644]	blob
examples/unres/MD/Multichain/1DKZ-gab-ene_GB000.int	[new file with mode: 0644]	blob
examples/unres/MD/Multichain/1DKZ-gab-ene_GB000.mol2	[new file with mode: 0644]	blob
examples/unres/MD/Multichain/1DKZ-gab-ene_GB000.pdb	[new file with mode: 0644]	blob
examples/unres/MD/Multichain/1DKZ-gab-ene_GB000.stat	[new file with mode: 0644]	blob
examples/unres/MD/Multichain/1DKZ.pdb	[new file with mode: 0644]	blob
examples/unres/MD/Multichain/ala10x2_gab-ber.inp	[new file with mode: 0644]	blob
examples/unres/MD/Multichain/ala10x2_gab-ber.intin	[new file with mode: 0644]	blob
examples/unres/MD/Multichain/ala10x2_gab-ber.out_GB000	[new file with mode: 0644]	blob
examples/unres/MD/Multichain/ala10x2_gab-ber_000.rst	[new file with mode: 0644]	blob
examples/unres/MD/Multichain/ala10x2_gab-ber_GB000.int	[new file with mode: 0644]	blob
examples/unres/MD/Multichain/ala10x2_gab-ber_GB000.mol2	[new file with mode: 0644]	blob
examples/unres/MD/Multichain/ala10x2_gab-ber_GB000.pdb	[new file with mode: 0644]	blob
examples/unres/MD/Multichain/ala10x2_gab-ber_GB000.stat	[new file with mode: 0644]	blob
examples/unres/MD/Multichain/ala10x2_gab-ber_MD000.pdb	[new file with mode: 0644]	blob
examples/unres/MD/Multichain/ala20.e53409	[new file with mode: 0644]	blob
examples/unres/MD/Multichain/ala20.e53410	[new file with mode: 0644]	blob
examples/unres/MD/Multichain/ala20.e53411	[new file with mode: 0644]	blob
examples/unres/MD/Multichain/ala20.e53412	[new file with mode: 0644]	blob
examples/unres/MD/Multichain/ala20.o53409	[new file with mode: 0644]	blob
examples/unres/MD/Multichain/ala20.o53410	[new file with mode: 0644]	blob
examples/unres/MD/Multichain/ala20.o53411	[new file with mode: 0644]	blob
examples/unres/MD/Multichain/ala20.o53412	[new file with mode: 0644]	blob
examples/unres/MD/Multichain/fort.12	[new file with mode: 0644]	blob
examples/unres/MD/Multichain/start.mat	[new file with mode: 0755]	blob
examples/unres/MD/Multichain/unres.csh	[new file with mode: 0755]	blob
source/unres/src_MD-M/.symbolsizes.txt.swp	[deleted file]	blob \| history
source/unres/src_MD-M/CMakeLists.txt		diff \| blob \| history
source/unres/src_MD-M/xdrf/CMakeLists.txt		diff \| blob \| history
source/unres/src_MD-M/xdrf2pdb/Makefile_linux~	[deleted file]	blob \| history
source/unres/src_MD/CMakeLists.txt		diff \| blob \| history
source/unres/src_MIN/CMakeLists.txt	[new file with mode: 0644]	blob
source/unres/src_MIN/cinfo.f.new	[deleted file]	blob \| history
source/unres/src_MIN/energy_p_new_barrier.F		diff \| blob \| history

UNRESPACK 3.x

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