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wham & cluster src_MD-M new HOMOL energy
[unres.git] / source /
2018-05-16 Cezary Czaplewskiwham & cluster src_MD-M new HOMOL energy tree | commitdiff
2018-05-16 Cezary Czaplewskiunres src_MD-M now HOMOL energy tree | commitdiff
2018-05-16 Cezary Czaplewskienergy_dec src_MD tree | commitdiff
2018-05-15 Cezary Czaplewskigfortran error for wham_m tree | commitdiff
2018-05-07 Cezary CzaplewskiHOMOL klapaucjusz correction tree | commitdiff
2018-04-25 Cezary CzaplewskiHOMOL wham/cluster new dihed constrain cos function tree | commitdiff
2018-04-24 Cezary CzaplewskiHOMOL new dihed constrain cos function tree | commitdiff
2018-04-24 Cezary Czaplewskireadpdb lside1 correction tree | commitdiff
2018-04-23 Cezary Czaplewskinew HOMOL energy wham & cluster tree | commitdiff
2018-04-20 Cezary Czaplewskinew HOMOL energy tree | commitdiff
2018-04-17 Cezary Czaplewskirescore=0.2 rescore2=1.0 mdpdb append tree | commitdiff
2018-04-05 Cezary CzaplewskiAdam's corrections to HOMOL_FRAG program tree | commitdiff
2018-04-05 Cezary Czaplewskiprogram genereating HOMOL_FRAG consensus fragments tree | commitdiff
2018-04-05 Cezary CzaplewskiENDMDL cluster_wham/src tree | commitdiff
2018-03-26 Cezary CzaplewskiREAD_HOMOL_FRAG cluster_wham tree | commitdiff
2018-03-26 Cezary CzaplewskiREAD_HOMOL_FRAG wham tree | commitdiff
2018-03-26 Cezary CzaplewskiREAD_HOMOL_FRAG tree | commitdiff
2018-03-22 Cezary Czaplewskiwham cluster ignores missing dat file for wdfab=0 tree | commitdiff
2018-03-22 Cezary Czaplewskiparallel DFA_D DFA_T DFA_N tree | commitdiff
2018-03-21 Cezary Czaplewskidfa prints correct error missing files tree | commitdiff
2018-03-21 Cezary CzaplewskiPARAM iter1_7p single chain tree | commitdiff
2018-02-02 Cezary Czaplewskiwham maxsym=10 tree | commitdiff
2018-01-31 Cezary Czaplewskimultichain geomout corrected tree | commitdiff
2018-01-27 Cezary Czaplewskicluster wham SACS cutoff tree | commitdiff
2018-01-27 Cezary Czaplewskiwham SAXS cutoff tree | commitdiff
2018-01-27 Cezary Czaplewskiwsaxs0 and map tree | commitdiff
2018-01-08 Cezary CzaplewskiSAXS cutoff saxs_cutoff.eq.0 tree | commitdiff
2018-01-03 Cezary CzaplewskiSAXS cutoff correct gradiend and cutoff scaling tree | commitdiff
2018-01-02 Cezary CzaplewskiSAXS cutoff correction tree | commitdiff
2018-01-02 Cezary CzaplewskiSAXS cutoff correction tree | commitdiff
2018-01-02 Cezary CzaplewskiSAXS cutoff tree | commitdiff
2017-12-22 Cezary Czaplewskixdrf2pdb D amino tree | commitdiff
2017-12-21 Cezary Czaplewskixdrf2pdb-m-mult time t_bath printout tree | commitdiff
2017-12-21 Cezary Czaplewskisaxs SCAL_RAD input parameter tree | commitdiff
2017-12-19 Cezary Czaplewskictest wham & cluster src-M tree | commitdiff
2017-12-17 Cezary Czaplewskisaxs and adam's corrections to multichain tree | commitdiff
2017-10-04 Cezary Czaplewskixdrf2pdb-m MREMD no uconst_back tree | commitdiff
2017-09-29 Cezary Czaplewskipgf90 common cleaning tree | commitdiff
2017-09-29 Cezary Czaplewskicmake pgf90 tree | commitdiff
2017-09-29 Cezary Czaplewskiisnan_pgi tree | commitdiff
2017-09-28 Cezary Czaplewskigfortran error tree | commitdiff
2017-09-28 Cezary Czaplewskigfortran error tree | commitdiff
2017-09-27 Cezary Czaplewskirm uscdiff tree | commitdiff
2017-09-26 Cezary Czaplewskirm uscdiff tree | commitdiff
2017-09-26 Cezary Czaplewskigfortran errors tree | commitdiff
2017-09-26 Cezary Czaplewskigfortran error tree | commitdiff
2017-09-26 Cezary Czaplewskicmake config typo tree | commitdiff
2017-09-26 Cezary Czaplewskigfortran wham and cluster -mcmodel=medium tree | commitdiff
2017-09-26 Cezary Czaplewskiimax0 not in gfortran tree | commitdiff
2017-09-25 Cezary Czaplewskidimensions tree | commitdiff
2017-08-26 Cezary Czaplewskifiles for opt-wtfsa-2 and chainbuild_ext tree | commitdiff
2017-08-25 Cezary Czaplewskiremd random start loop until low ene tree | commitdiff
2017-08-12 Cezary Czaplewskimultichain cleaning output tree | commitdiff
2017-08-12 Cezary Czaplewskimultichain cluster can select number of clusters instea... tree | commitdiff
2017-08-12 Cezary Czaplewskiunres multichain extconf MD chainbuild tree | commitdiff
2017-03-21 Cezary Czaplewskicompiler directive UNROLL(0) in eturn3 tree | commitdiff
2017-03-10 Cezary Czaplewskicorrect gradient on cray okeanos tree | commitdiff
2017-03-10 Cezary CzaplewskiAdasko D-aminoacid correction tree | commitdiff
2017-03-09 Cezary Czaplewskictest src_MD-M ref ene and missing files tree | commitdiff
2017-03-04 Cezary Czaplewskictest ene multichain tree | commitdiff
2017-03-03 Cezary Czaplewskictest too large output from some tests tree | commitdiff
2017-03-03 Cezary Czaplewskictest multichain tree | commitdiff
2017-03-02 Cezary Czaplewskictest wham cluster tree | commitdiff
2017-02-28 Cezary Czaplewskictest dfa and homology tree | commitdiff
2017-02-27 Cezary Czaplewskictest corrections tree | commitdiff
2017-02-27 Cezary Czaplewskictest checkgrad added tree | commitdiff
2017-02-27 Cezary Czaplewski checkgrad after minim with return code <> 4 tree | commitdiff
2017-02-24 Cezary Czaplewskicluster wham src-M corrections to match unres energy tree | commitdiff
2017-02-24 Cezary Czaplewskiwham src-M corrections to match unres energy tree | commitdiff
2017-02-23 Cezary Czaplewskicheckgrad_inc added to input for checkgrad cart tree | commitdiff
2017-02-23 Cezary Czaplewskihomology dihederal i-3 gradient correction src_MD tree | commitdiff
2017-02-22 Cezary Czaplewskihomology dihederal i-3 gradient correction tree | commitdiff
2017-02-22 Cezary Czaplewskifix checkgrad usampl conflict with homology tree | commitdiff
2017-02-22 Cezary Czaplewskicorrections to numerical and sccor analytical gradient tree | commitdiff
2017-02-16 Cezary Czaplewskienergy of unres src_MD-M match prerelease tree | commitdiff
2016-09-14 Cezary Czaplewskiincrease to 20 max nset waga_homology(20) tree | commitdiff
2016-09-13 Cezary CzaplewskiHOMOL_NSET in wham input keyword correction tree | commitdiff
2016-08-24 Cezary CzaplewskiLorentzian restraints on distances in cluster_wham tree | commitdiff
2016-08-24 Cezary CzaplewskiLorentzian restraints on distances in wham tree | commitdiff
2016-08-23 Cezary CzaplewskiLorenz restraints on distances tree | commitdiff
2016-07-04 Cezary Czaplewskimultichain debug print removed (no fort.2 file) tree | commitdiff
2016-07-04 Cezary Czaplewskimultichain maxres=1000 tree | commitdiff
2016-06-26 Cezary Czaplewskiwham also in single chain ignores conf. energies>10E6 tree | commitdiff
2016-06-19 Cezary Czaplewskicorrection for idihconstr_end_homo, no differ in wham now tree | commitdiff
2016-06-14 Cezary Czaplewskimultichain wham and cluster_wham use readpdb_template tree | commitdiff
2016-06-11 Cezary Czaplewskicorrection to the last commit - cleaning of homo restraints tree | commitdiff
2016-06-10 Cezary Czaplewskimultichain wham ignores conf. energies>10E6 and speed... tree | commitdiff
2016-06-08 Cezary Czaplewskisingle chain correction of dihedral homology restraints... tree | commitdiff
2016-06-08 Cezary Czaplewskiunres src_MD max_template=25 tree | commitdiff
2016-05-25 Cezary Czaplewskiintel compiler option correction for wham/src-M tree | commitdiff
2016-05-19 Cezary Czaplewskiminim and preminim in cart for large proteins tree | commitdiff
2016-05-19 Cezary Czaplewskistart_from_models working with multichain tree | commitdiff
2016-05-19 Cezary Czaplewskicorrection of dihedral homology restraints phi(i+3) tree | commitdiff
2016-05-12 Cezary CzaplewskiMaxT_h=36 tree | commitdiff
2016-05-12 Cezary Czaplewskithe first working version of multichain homology tree | commitdiff
2016-05-10 Cezary Czaplewskiupdates from src_MD to src_MD-M for unres tree | commitdiff
2016-05-05 Cezary Czaplewskidfa wham and cluster corrections tree | commitdiff
2016-05-05 Cezary Czaplewskiread2sigma in wham and cluster_wham tree | commitdiff
2016-04-29 Cezary CzaplewskiDIST2_CUT correction tree | commitdiff
2016-04-29 Cezary Czaplewskinext correction to last commit with DIST2_CUT tree | commitdiff
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