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BioMemPhys-FAU
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domhmm
Open source package to identify nano- and microdomains in Molecular Dynamics simulations of bio-membranes.
https://www.biomemphys.nat.fau.de
GNU General Public License v2.0
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Pinning fixed versions for dependencies
#53
m-a-r-i-u-s
opened
1 day ago
0
Dependency Update
#52
yusuferentunc
closed
2 days ago
0
Update base.py
#51
m-a-r-i-u-s
closed
1 week ago
0
Documentation Updates on TMD Protein and Asymmetric Membrane
#49
yusuferentunc
closed
2 weeks ago
0
Update Readthedocs configuration
#48
yusuferentunc
closed
2 weeks ago
0
Update domhmm.py - Fix residue ordering
#47
m-a-r-i-u-s
closed
2 weeks ago
0
implement logic of transmembrane domain inclusion into the area per lipid calculation
#46
yusuferentunc
closed
1 month ago
1
Transmembrane Domain Adaptation
#45
yusuferentunc
closed
2 weeks ago
2
Fix residue indexing
#44
yusuferentunc
closed
1 month ago
0
Reuse HMM Tests and Documentation
#43
yusuferentunc
closed
1 month ago
0
Fix resid order
#42
yusuferentunc
closed
1 month ago
0
Parallelise DomHMM
#41
yusuferentunc
opened
1 month ago
1
topology has to have all the lipids before the cholesterol (by resnum)
#40
n1c0pk
closed
1 month ago
2
Reuse hmm
#39
m-a-r-i-u-s
closed
1 month ago
0
Introduced tqdm
#38
m-a-r-i-u-s
closed
1 month ago
1
Add clustering for both leaflets
#37
m-a-r-i-u-s
closed
2 months ago
0
Fix double counting of residues
#36
m-a-r-i-u-s
closed
2 months ago
0
Fix error cause of lipid locating only in one leaflet
#35
yusuferentunc
closed
2 months ago
0
Bug - Asymmetric Membrane for lipids in just one leaflet
#34
m-a-r-i-u-s
closed
2 months ago
3
Update base.py
#33
m-a-r-i-u-s
closed
2 months ago
0
Clustering Result Implementation
#32
yusuferentunc
closed
2 months ago
0
Documentation Implementation
#31
yusuferentunc
closed
2 months ago
0
Add GMM and HMM Parameters
#30
yusuferentunc
closed
2 months ago
0
Logging Implementation
#29
yusuferentunc
closed
2 months ago
0
New leaflet selection interface
#28
m-a-r-i-u-s
closed
2 months ago
0
Update unit tests
#27
m-a-r-i-u-s
closed
2 months ago
1
Added fix for vornoi area calculation
#26
m-a-r-i-u-s
closed
2 months ago
0
LeafletFinder Removal in MDAnalysis 3.0.0
#25
m-a-r-i-u-s
opened
3 months ago
1
Made leaflet selection rate a user-defined variable. Default is set t…
#24
m-a-r-i-u-s
closed
3 months ago
0
Leaflet Wise Training for Asymmetric Simulations
#23
yusuferentunc
closed
3 months ago
0
Z Score Calculation
#22
yusuferentunc
closed
3 months ago
0
Sparse Weight Matrix
#21
yusuferentunc
closed
3 months ago
0
Order Parameter Calculation Fix
#20
yusuferentunc
closed
3 months ago
0
Unit Test Implementation
#19
yusuferentunc
closed
3 months ago
0
Option for Leaflet Oriented Model Training
#18
yusuferentunc
closed
3 months ago
0
Speed up Voronoi
#17
m-a-r-i-u-s
closed
3 months ago
2
Data fix
#16
yusuferentunc
closed
4 months ago
0
Sterol and Flip-Flop Logic Implementation
#15
yusuferentunc
closed
4 months ago
0
Something to take care of!
#14
m-a-r-i-u-s
closed
3 months ago
4
DomHMM Implementation
#13
yusuferentunc
closed
4 months ago
0
User Friendly Options
#12
yusuferentunc
opened
4 months ago
0
Involing of Cholesterol and Flip-Flop Solution
#11
yusuferentunc
closed
4 months ago
2
Analysis Result Data Change
#10
yusuferentunc
closed
4 months ago
0
DomHMM Implementation Fix
#9
yusuferentunc
closed
4 months ago
3
Pipeline fix
#8
yusuferentunc
closed
5 months ago
0
Local Normal Calculation Method
#7
yusuferentunc
opened
5 months ago
0
Area Per Lipid Calculation
#6
yusuferentunc
closed
5 months ago
2
Adaptation of DomHMM to General Simulations
#5
yusuferentunc
closed
2 weeks ago
2
Packaging DomHMM
#4
yusuferentunc
opened
6 months ago
2
CI Upgrade and Unit Tests for DomHMM
#3
yusuferentunc
closed
3 months ago
4
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