working martini
[unres4.git] / source / unres / control.F90
2023-07-04 Adam Sieradzanworking martini UCGM
2023-06-13 Adam Sieradzancleaning water
2023-04-03 Adam SieradzanNEWCORR5D working with 15k, work and iwork in random_ve...
2023-03-08 Adam Sieradzanadded NEWCORR5D
2022-07-30 Adam SieradzanMerge branch 'UCGM' of mmka.chem.univ.gda.pl:unres4...
2022-01-19 Adam SieradzanAdding MARTINI
2021-05-21 Anna Antoniakintrodaction of homology into UNICORN
2020-09-30 Anna AntoniakImplementation of ions into NARES
2020-03-18 Adam Sieradzanworking cutoff
2018-05-07 Adam Sieradzanrenamining + shielding parallel
2018-05-02 Adam SieradzanBUG found in SC-SC grad and FGPROC>1
2018-05-02 Adam SieradzanMPI shield
2018-04-06 Emilia Lubeckachanges for added xdrfpdb
2018-01-29 Adam Sieradzandebug changes
2018-01-29 Adam Sieradzanchanges in wham and unres
2017-11-30 Adam Sieradzancorrection in MREMD NPROC and writing and reading ...
2017-11-29 Adam Sieradzanworking peptide-phosphate
2017-11-27 Adam Sieradzanworking side-chain phosphate
2017-11-22 Adam Sieradzanworking base with peptide group
2017-11-05 Adam Sieradzanworking SC-base energy
2017-09-29 Adam Sieradzanworking microcanonical for CA2+ protein
2017-08-18 Adam Sieradzanworking microcanonical
2017-08-16 Adam Sieradzanworking gradient
2017-08-11 Adam Sieradzanenergi calculation working (no weights!)
2017-08-11 Adam Sieradzanworking ESBLOC
2017-08-09 Adam Sieradzanworkink EVDW i EES for PP,SB,PSB- warning energies...
2017-08-06 Adam Sieradzanworking torsional
2017-08-06 Adam Sieradzanadding ebend_nucl to UCGM+some further reading
2017-08-04 Adam SieradzanMerge branch 'devel' into UCGM
2017-08-03 Adam Sieradzansplit matrices working reading pdb
2017-08-02 Adam Sieradzanreading from extended mutliple sequence
2017-08-01 Adam SieradzanThe itype(;) extension to itype(:,:)
2017-07-31 Adam Sieradzantriss; AFM; Lorentz restrains included -debug might...
2017-07-14 Adam Sieradzanworking nano
2017-07-06 Adam Sieradzanworking energy for shield and lipid wrong gradient
2017-02-15 Cezary Czaplewskicmake for unres4 wham