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renamining + shielding parallel
2018-05-07 Adam Sieradzanrenamining + shielding parallel
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2018-05-03 Adam Sieradzancorrection for gfortran
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2018-05-02 Adam SieradzanBUG found in SC-SC grad and FGPROC>1
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2018-05-02 Adam SieradzanMPI shield
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2018-04-30 Adam SieradzanMerge branch 'UCGM' of mmka.chem.univ.gda.pl:unres4...
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2018-04-30 Adam Sieradzanchanges in shielding
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2018-04-04 Adam SieradzanMerge branch 'UCGM' of mmka.chem.univ.gda.pl:unres4...
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2018-04-04 Adam Sieradzanextension tu fosforylated potentials
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2018-03-23 Adam SieradzanMerge branch 'UCGM' of mmka.chem.univ.gda.pl:unres4...
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2018-03-23 Adam Sieradzanchanges for phosphorylated amino-acid
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2018-02-06 Adam Sieradzancritial bugfix for extconf
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2018-02-05 Adam Sieradzancorrrection in energies (no trash)
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2018-01-30 Adam SieradzanCB to O3 change
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2018-01-30 Adam Sieradzanchanges to debug
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2018-01-29 Adam SieradzanDEBUG MODE ON segmentation fault
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2018-01-29 Adam Sieradzandebug changes
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2018-01-29 Adam Sieradzanchanges in wham and unres
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2018-01-11 Adam SieradzanMerge branch 'UCGM' of mmka.chem.univ.gda.pl:unres4...
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2018-01-11 Adam Sieradzanstart of wham
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2018-01-11 Adam Sieradzancorrection in returnbox
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2018-01-04 Adam Sieradzancorrect in readpdb and in fcopy allocate
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2017-12-28 Adam Sieradzanin debug mode on
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2017-12-19 Adam Sieradzancritical bug in set_matrices
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2017-12-19 Adam Sieradzansome commit
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2017-12-12 Adam Sieradzanparallel ions
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2017-11-30 Adam Sieradzanpsuedo finegraining for UCGM
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2017-11-30 Adam Sieradzancorrection in MREMD NPROC and writing and reading ...
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2017-11-29 Adam Sieradzanadding parameters for interaction base with protein
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2017-11-29 Adam Sieradzanworking peptide-phosphate
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2017-11-27 Adam Sieradzanworking side-chain phosphate
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2017-11-22 Adam Sieradzanworking base with peptide group
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2017-11-05 Adam Sieradzanworking SC-base energy
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2017-09-29 Adam Sieradzanworking microcanonical for CA2+ protein
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2017-08-18 Adam Sieradzancorrection of gamsc
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2017-08-18 Adam Sieradzanworking microcanonical
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2017-08-17 Adam Sieradzancorrection for if; microcanonical working
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2017-08-17 Adam SieradzanMD changes micorcanononical not working
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2017-08-16 Adam Sieradzanworking gradient
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2017-08-11 Adam Sieradzanenergi calculation working (no weights!)
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2017-08-11 Adam Sieradzanworking ESBLOC
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2017-08-09 Adam Sieradzanworkink EVDW i EES for PP,SB,PSB- warning energies...
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2017-08-06 Adam Sieradzanworking torsional
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2017-08-06 Adam Sieradzanadding ebend_nucl to UCGM+some further reading
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2017-08-04 Adam SieradzanMerge branch 'devel' into UCGM
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2017-08-04 Adam Sieradzandebug for etube for too long wheightcard
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2017-08-03 Adam Sieradzansplit matrices working reading pdb
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2017-08-02 Adam Sieradzanreading from extended mutliple sequence
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2017-08-01 Adam SieradzanThe itype(;) extension to itype(:,:)
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2017-07-31 Adam Sieradzantriss; AFM; Lorentz restrains included -debug might...
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2017-07-25 Adam Sieradzanzmiany w MD
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2017-07-14 Adam Sieradzancorrected rst file
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2017-07-14 Adam Sieradzanworking nano
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2017-07-07 Adam Sieradzanworking gradient for lipid and shielding
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2017-07-06 Adam Sieradzanworking energy for shield and lipid wrong gradient
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2017-05-04 Adam Sieradzanworking PBC
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2017-04-29 Adam Sieradzanenergy fr PBC workin ene,grad,symp_chek OK, for respa...
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2017-04-28 Adam SieradzanGradient correct, 180deg problem unresolved
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2017-04-27 Adam Sieradzanworking gradient for ecorr (wcorrh)
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2017-04-27 Adam Sieradzanchanges for ees working (no split mode)
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2017-04-26 Adam Sieradzanbug fix for vdwpp, vdwpp workin, wscp not working in...
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2017-04-26 Adam Sieradzanworking gradient for WSCP (no -respa only)
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2017-04-25 Adam Sieradzanchanges needed for respa for evdw
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2017-04-25 Adam SieradzanPBC working for EGB (only)
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2015-07-17 Adam Sieradzanbug fix in SCcorr gradient
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UNRESPACK 4.x