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(parent: a30bd29) | patch
src-HCD-5D update
authorCezary Czaplewski <czarek@chem.univ.gda.pl>
Tue, 24 Mar 2020 07:01:06 +0000 (08:01 +0100)
committerCezary Czaplewski <czarek@chem.univ.gda.pl>
Tue, 24 Mar 2020 07:01:06 +0000 (08:01 +0100)
commitfb31d9cf50bce06dbfae62c92c11f3e9c836f405
treecf8255150d34f4c697d007869db51efe25005ccetree | snapshot
parenta30bd29e64da2aa47b84963fdd0bf4192ead2738commit | diff
src-HCD-5D update
61 files changed:
source/unres/src-HCD-5D/COMMON.CONTMAT [new file with mode: 0644] blob
source/unres/src-HCD-5D/COMMON.CONTROL.org [new file with mode: 0644] blob
source/unres/src-HCD-5D/COMMON.CORRMAT [new file with mode: 0644] blob
source/unres/src-HCD-5D/COMMON.FRAG [new file with mode: 0644] blob
source/unres/src-HCD-5D/COMMON.HOMOLOGY [new file with mode: 0644] blob
source/unres/src-HCD-5D/COMMON.LAGRANGE [new file with mode: 0644] blob
source/unres/src-HCD-5D/COMMON.LAGRANGE.5diag [new file with mode: 0644] blob
source/unres/src-HCD-5D/COMMON.LANGEVIN.lang0.5diag [new file with mode: 0644] blob
source/unres/src-HCD-5D/COMMON.LANGEVIN.lang0.org [new file with mode: 0644] blob
source/unres/src-HCD-5D/COMMON.LANGEVIN.org [new file with mode: 0644] blob
source/unres/src-HCD-5D/COMMON.MD.org [new file with mode: 0644] blob
source/unres/src-HCD-5D/COMMON.QRESTR [new file with mode: 0644] blob
source/unres/src-HCD-5D/COMMON.SAXS [new file with mode: 0644] blob
source/unres/src-HCD-5D/MD_A-MTS.optrpt [new file with mode: 0644] blob
source/unres/src-HCD-5D/TODO.AFTER.CASP14 [new file with mode: 0644] blob
source/unres/src-HCD-5D/cart2intgrad.F [new file with mode: 0644] blob
source/unres/src-HCD-5D/cartder.F.org [new file with mode: 0644] blob
source/unres/src-HCD-5D/cartder.F.orig [new file with mode: 0644] blob
source/unres/src-HCD-5D/check_cartgrad.F [new file with mode: 0644] blob
source/unres/src-HCD-5D/check_ecartint_CASC_NC.F [new file with mode: 0644] blob
source/unres/src-HCD-5D/check_vecgrad.F [new file with mode: 0644] blob
source/unres/src-HCD-5D/contact_cp.F [new file with mode: 0644] blob
source/unres/src-HCD-5D/energy_p_new-sep_barrier.optrpt [new file with mode: 0644] blob
source/unres/src-HCD-5D/energy_p_new_barrier.F.chuj [new file with mode: 0644] blob
source/unres/src-HCD-5D/energy_p_new_barrier.F.safe [new file with mode: 0644] blob
source/unres/src-HCD-5D/energy_p_new_barrier.optrpt [new file with mode: 0644] blob
source/unres/src-HCD-5D/fdiag.f [new file with mode: 0644] blob
source/unres/src-HCD-5D/fdisy.f [new file with mode: 0644] blob
source/unres/src-HCD-5D/gradient_p.F.new [new file with mode: 0644] blob
source/unres/src-HCD-5D/gradient_p.F.org [new file with mode: 0644] blob
source/unres/src-HCD-5D/gradient_p.F.org.debug [new file with mode: 0644] blob
source/unres/src-HCD-5D/gradient_p.optrpt [new file with mode: 0644] blob
source/unres/src-HCD-5D/inform.f [new file with mode: 0644] blob
source/unres/src-HCD-5D/iounit.f [new file with mode: 0644] blob
source/unres/src-HCD-5D/keys.f [new file with mode: 0644] blob
source/unres/src-HCD-5D/kinetic_CASC.F [new file with mode: 0644] blob
source/unres/src-HCD-5D/kinetic_lesyng.F [new file with mode: 0644] blob
source/unres/src-HCD-5D/kinetic_lesyng.F.safe [new file with mode: 0644] blob
source/unres/src-HCD-5D/lagrangian_lesyng.optrpt [new file with mode: 0644] blob
source/unres/src-HCD-5D/lbfgs.F [new file with mode: 0644] blob
source/unres/src-HCD-5D/linmin.f [new file with mode: 0644] blob
source/unres/src-HCD-5D/machpd.f [new file with mode: 0644] blob
source/unres/src-HCD-5D/map.F [new file with mode: 0644] blob
source/unres/src-HCD-5D/math.f [new file with mode: 0644] blob
source/unres/src-HCD-5D/minima.f [new file with mode: 0644] blob
source/unres/src-HCD-5D/moments.F [new file with mode: 0644] blob
source/unres/src-HCD-5D/muca_md.F [new file with mode: 0644] blob
source/unres/src-HCD-5D/optsave.f [new file with mode: 0644] blob
source/unres/src-HCD-5D/optsave_dum.f [new file with mode: 0644] blob
source/unres/src-HCD-5D/output.f [new file with mode: 0644] blob
source/unres/src-HCD-5D/sc_minimize.F [new file with mode: 0644] blob
source/unres/src-HCD-5D/scales.f [new file with mode: 0644] blob
source/unres/src-HCD-5D/search.f [new file with mode: 0644] blob
source/wham/src-HCD-5D/COMMON.CONTMAT [new file with mode: 0644] blob
source/wham/src-HCD-5D/COMMON.CORRMAT [new file with mode: 0644] blob
source/wham/src-HCD-5D/chainbuild.rrr [new file with mode: 0644] blob
source/wham/src-HCD-5D/include_unres/COMMON.CONTACTS.safe [new file with mode: 0644] blob
source/wham/src-HCD-5D/include_unres/COMMON.CONTMAT [new file with mode: 0644] blob
source/wham/src-HCD-5D/include_unres/COMMON.CORRMAT [new file with mode: 0644] blob
source/wham/src-HCD-5D/module [new file with mode: 0644] blob
source/wham/src-HCD-5D/readpdb.unr [new file with mode: 0644] blob
UNRESPACK 3.x