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(initial) | patch
added source code v.3.0
authorDawid Jagieła <lightnir@chem.univ.gda.pl>
Sat, 25 Feb 2012 12:55:23 +0000 (13:55 +0100)
committerDawid Jagieła <lightnir@chem.univ.gda.pl>
Sat, 25 Feb 2012 12:55:23 +0000 (13:55 +0100)
commit478a9d9a1c99eb3f4bc4ca676ff3162bdd01d633
tree87a25e7129b1582894cf35c09dc5d1a54e3ca1d2tree | snapshot
added source code
2959 files changed:
PARAM/1b5c.cart [new file with mode: 0644] blob
PARAM/1bgh.cart [new file with mode: 0644] blob
PARAM/1ctt02.cart [new file with mode: 0644] blob
PARAM/1igd.cart [new file with mode: 0644] blob
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PARAM/1igf.cart [new file with mode: 0644] blob
PARAM/aa [new file with mode: 0644] blob
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PARAM/cend.3.45.parm [new file with mode: 0644] blob
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PARAM/electr_631Gdp.parm [new file with mode: 0644] blob
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PARAM/fourier_631Gdp-AAAA-G-P.parm [new file with mode: 0644] blob
PARAM/fourier_GAP.parm [new file with mode: 0644] blob
PARAM/fourier_loc_fit.parm [new file with mode: 0644] blob
PARAM/fourier_loc_newfit_test.parm [new file with mode: 0644] blob
PARAM/fourier_opt.parm.1e0l_1enh_PAR5-Sq2-11-class2_sccum_q1_shan8r [new file with mode: 0644] blob
PARAM/fourier_opt.parm.1igd_hc_iter3_3 [new file with mode: 0644] blob
PARAM/fourier_opt.parm.1igd_iter7n_c [new file with mode: 0644] blob
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PARAM/sc_GB_opt.1e0g-52-17k-2k-newclass-shan1e9_gap8g-sc [new file with mode: 0644] blob
PARAM/sc_GB_opt.1e0l_1enh_PAR5-Sq2-11-class2_sccum_q1_shan8r [new file with mode: 0644] blob
PARAM/sc_GB_opt.1e0l_MD_iter2_4T_hier3_allr [new file with mode: 0644] blob
PARAM/sc_GB_opt.1gab_3S_qclass5no310-shan2-sc-16-10-8k [new file with mode: 0644] blob
PARAM/sc_GB_opt.1igd_hnc_iter8scsc_8nn1 [new file with mode: 0644] blob
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PARAM/torsion_631Gdp.parm [new file with mode: 0644] blob
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PARAM/torsion_cryst.parm [new file with mode: 0644] blob
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PARAM/torsion_double_abinitio.parm [new file with mode: 0644] blob
PARAM/torsion_ecepp.parm [new file with mode: 0644] blob
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bin/cluster/cluster-unres.csh [new file with mode: 0755] blob
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examples/unres/CSA/3P/CSA/1igd_3P.CSA.seed [new file with mode: 0644] blob
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examples/unres/CSA/3P/CSA/output/1igd_3P.CSA.bank [new file with mode: 0644] blob
examples/unres/CSA/3P/CSA/output/1igd_3P.CSA.bank1 [new file with mode: 0644] blob
examples/unres/CSA/3P/CSA/output/1igd_3P.CSA.history [new file with mode: 0644] blob
examples/unres/CSA/3P/CSA/output/1igd_3P.CSA.rbank [new file with mode: 0644] blob
examples/unres/CSA/3P/CSA/output/1igd_3P.out_GB000 [new file with mode: 0644] blob
examples/unres/CSA/3P/CSA/output/1igd_3P@001.pdb.gz [new file with mode: 0644] blob
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source/wham/src/xdrf.org/xdr_float.c [new file with mode: 0644] blob
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source/wham/src/xread.F [new file with mode: 0644] blob
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source/xdrfpdb/src-M/COMMON.DISTFIT [new file with mode: 0644] blob
source/xdrfpdb/src-M/COMMON.FFIELD [new file with mode: 0644] blob
source/xdrfpdb/src-M/COMMON.GEO [new file with mode: 0644] blob
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source/xdrfpdb/src-M/COMMON.INTERACT [new file with mode: 0644] blob
source/xdrfpdb/src-M/COMMON.IOUNITS [new file with mode: 0644] blob
source/xdrfpdb/src-M/COMMON.LOCAL [new file with mode: 0644] blob
source/xdrfpdb/src-M/COMMON.MD [new file with mode: 0644] blob
source/xdrfpdb/src-M/COMMON.NAMES [new file with mode: 0644] blob
source/xdrfpdb/src-M/COMMON.SBRIDGE [new file with mode: 0644] blob
source/xdrfpdb/src-M/COMMON.VAR [new file with mode: 0644] blob
source/xdrfpdb/src-M/DIMENSIONS [new file with mode: 0644] blob
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source/xdrfpdb/src-M/ftocstr.c [new file with mode: 0644] blob
source/xdrfpdb/src-M/geomout.F [new file with mode: 0644] blob
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source/xdrfpdb/src-M/xdrf [new symlink] blob
source/xdrfpdb/src-M/xdrf.h [new file with mode: 0644] blob
source/xdrfpdb/src-M/xdrf2pdb-m.F [new file with mode: 0644] blob
source/xdrfpdb/src-M/xdrf2pdb.F [new file with mode: 0644] blob
source/xdrfpdb/src-M/xdrf2pdb1.f [new file with mode: 0644] blob
source/xdrfpdb/src-M/xdrf2x.F [new file with mode: 0644] blob
source/xdrfpdb/src/COMMON.CHAIN [new file with mode: 0644] blob
source/xdrfpdb/src/COMMON.DISTFIT [new file with mode: 0644] blob
source/xdrfpdb/src/COMMON.FFIELD [new file with mode: 0644] blob
source/xdrfpdb/src/COMMON.GEO [new file with mode: 0644] blob
source/xdrfpdb/src/COMMON.HEADER [new file with mode: 0644] blob
source/xdrfpdb/src/COMMON.INTERACT [new file with mode: 0644] blob
source/xdrfpdb/src/COMMON.IOUNITS [new file with mode: 0644] blob
source/xdrfpdb/src/COMMON.LOCAL [new file with mode: 0644] blob
source/xdrfpdb/src/COMMON.MD [new file with mode: 0644] blob
source/xdrfpdb/src/COMMON.NAMES [new file with mode: 0644] blob
source/xdrfpdb/src/COMMON.SBRIDGE [new file with mode: 0644] blob
source/xdrfpdb/src/COMMON.VAR [new file with mode: 0644] blob
source/xdrfpdb/src/DIMENSIONS [new file with mode: 0644] blob
source/xdrfpdb/src/Makefile [new file with mode: 0644] blob
source/xdrfpdb/src/arcos.f [new file with mode: 0644] blob
source/xdrfpdb/src/ftocstr.c [new file with mode: 0644] blob
source/xdrfpdb/src/geomout.F [new file with mode: 0644] blob
source/xdrfpdb/src/intcor.f [new file with mode: 0644] blob
source/xdrfpdb/src/misc.f [new file with mode: 0644] blob
source/xdrfpdb/src/nazwy.f [new file with mode: 0644] blob
source/xdrfpdb/src/rescode.f [new file with mode: 0644] blob
source/xdrfpdb/src/xdrf [new symlink] blob
source/xdrfpdb/src/xdrf.h [new file with mode: 0644] blob
source/xdrfpdb/src/xdrf2ang-old.f [new file with mode: 0644] blob
source/xdrfpdb/src/xdrf2ang.f [new file with mode: 0644] blob
source/xdrfpdb/src/xdrf2pdb-m.F [new file with mode: 0644] blob
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source/xdrfpdb/src/xdrf2pdb1.f [new file with mode: 0644] blob
source/xdrfpdb/src/xdrf2x.F [new file with mode: 0644] blob
source/xdrfpdb/src/xdrf2x1.f [new file with mode: 0644] blob
UNRESPACK 3.x