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Rafal's code for NMR restraints
[django_unres.git]
/
django_simple
/
todo
/ models.py
2021-05-10
Cezary Czaplewski
Rafal's code for NMR restraints
master
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2020-09-03
Cezary Czaplewski
number of clusters <> 5
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2020-09-02
Cezary Czaplewski
preparation for number of clusters <> 5
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2020-02-25
Cezary Czaplewski
UNRES-Dock peptide sequence no pdb
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2020-02-12
Cezary Czaplewski
pbs qdel not done jobs on rm
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2020-02-05
Cezary Czaplewski
dock peptide
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2019-10-16
Cezary Czaplewski
NEWCT-9P force field
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2018-06-29
Cezary Czaplewski
default ntwx=1000
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2018-04-12
Cezary Czaplewski
mdpdb correction
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2018-04-10
Cezary Czaplewski
restart for md and remd
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2018-04-09
Cezary Czaplewski
docking - beta version, only basic
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2018-01-30
Cezary Czaplewski
tutorial update, d-amino correction
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2018-01-25
Cezary Czaplewski
saxs input data normalization and plot for input pdb
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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 correction
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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
saxs restraints
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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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2017-09-12
Cezary Czaplewski
problems with json ssbond
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2017-08-26
Cezary Czaplewski
new force field option
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2017-08-21
Cezary Czaplewski
free energy and ave rmsd for models in remd
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2017-08-21
Cezary Czaplewski
initial git commit
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