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Rafal's code for NMR restraints
[django_unres.git]
/
django_simple
/
todo
/ forms.py
2021-05-10
Cezary Czaplewski
Rafal's code for NMR restraints
master
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commitdiff
2020-09-03
Cezary Czaplewski
number of clusters <> 5
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2020-02-27
Cezary Czaplewski
NREP - number of temperatures
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2020-02-25
Cezary Czaplewski
UNRES-Dock peptide sequence no pdb
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2020-02-05
Cezary Czaplewski
dock spellcheck
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2020-02-05
Cezary Czaplewski
dock peptide adv
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2020-02-05
Cezary Czaplewski
dock peptide
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2020-02-04
Cezary Czaplewski
docking working version
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2018-04-12
Cezary Czaplewski
limits for nstep<10000000 and ntwx>100
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2018-04-12
Cezary Czaplewski
mdpdb correction
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2018-04-12
Cezary Czaplewski
text corrections (CA rms, input/output description)
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2018-04-09
Cezary Czaplewski
docking - beta version, only basic
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2018-01-30
Cezary Czaplewski
long job names (40 char) no respa for D amino
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2018-01-28
Cezary Czaplewski
random SEED value in forms
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2018-01-25
Cezary Czaplewski
remd preminim maxfun input
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2018-01-24
Cezary Czaplewski
aminoacid list update and chain without CA correction
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2018-01-23
Cezary Czaplewski
T0882 example in advanced MREMD, checking of residue...
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2018-01-22
Cezary Czaplewski
pdbid:chain added
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2018-01-22
Cezary Czaplewski
FF2 name for E0LL2Y
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2018-01-18
Cezary Czaplewski
secondary structure restraints for md and remd
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2017-12-22
Cezary Czaplewski
switch for respa, D aminoacids, saxs tutorial, license
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2017-12-22
Cezary Czaplewski
saxs restraints
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2017-12-13
Cezary Czaplewski
fluct_plot multichain correction
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2017-12-12
Cezary Czaplewski
missing residues error for pdb file or id
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2017-11-20
Cezary Czaplewski
use pdbid to load pdb and set all examples
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2017-11-20
Cezary Czaplewski
use pdbid to load pdb and set example input
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2017-11-10
Cezary Czaplewski
BOX dimensions input in advanced mode
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2017-08-27
Cezary Czaplewski
ntwx for remd (trajcache)
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2017-08-26
Cezary Czaplewski
new force field option
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2017-08-21
Cezary Czaplewski
initial git commit
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