issues
search
NMRLipids
/
MATCH
GNU General Public License v2.0
4
stars
14
forks
source link
issues
Newest
Newest
Most commented
Recently updated
Oldest
Least commented
Least recently updated
Trying to calculate order parameter for POPC.
#97
sathishdasari
opened
10 months ago
1
Form factor script and FF results for POPC cholesterol simulations
#96
nencini
closed
3 years ago
0
Fixed typo in PG alpha OP (Borle and Seelig)
#95
markussmiettinen
closed
3 years ago
0
Added POPE 310K C36UA and Slipids data in final-plot style.
#94
markussmiettinen
closed
3 years ago
0
Pure DPPE data in the final-plot format
#93
markussmiettinen
closed
3 years ago
0
Something wrong with a 310K Slipids POPE data set
#92
markussmiettinen
closed
3 years ago
1
Added a missing hashtag
#91
markussmiettinen
closed
3 years ago
0
Fixed problems that arose when using Amber force field
#90
markussmiettinen
closed
3 years ago
0
Amber example
#89
markussmiettinen
closed
4 years ago
0
Form factor molecules with multiple g3s
#88
markussmiettinen
closed
4 years ago
0
Form factor bulk electron density: Calculation from the sum of all components
#87
markussmiettinen
closed
4 years ago
0
Adding a two-component test system for form factor calculation
#86
markussmiettinen
closed
4 years ago
0
License Issue
#85
SimoneScrima
closed
4 years ago
1
new 500 lipids
#84
peonqan
closed
4 years ago
0
README.md and other files missing from https://github.com/NMRLipids/MATCH/tree/master/Data/Lipid_Bilayers/POPG%2B30%25POPC/T310K/MODEL_CHARMM36
#83
ohsOllila
closed
4 years ago
2
Possibly incorret tpr file in this repo: https://doi.org/10.5281/zenodo.3237488
#82
ohsOllila
closed
4 years ago
2
chloride number density for POPS/POPC mixture with Lipid17
#81
batukav
closed
5 years ago
0
POPG+30%POPC systems
#80
ohsOllila
opened
5 years ago
5
https://github.com/NMRLipids/MATCH/tree/master/Data/Lipid_Bilayers/POPG%2B150mNaCl/T310K/MODEL_GROMOS-CKP
#79
ohsOllila
closed
5 years ago
1
https://github.com/NMRLipids/MATCH/tree/master/Data/Lipid_Bilayers/POPE/T310K/MODEL_LIPID17_500lipids
#78
ohsOllila
closed
5 years ago
1
Na cl500lipids
#77
peonqan
closed
5 years ago
1
README files in commit https://github.com/NMRLipids/MATCH/pull/75
#76
ohsOllila
opened
5 years ago
0
Na cl500lipids
#75
peonqan
closed
5 years ago
2
Update calc_FORM_FACTOR.sh
#74
hsantila
opened
5 years ago
4
Update calc_FORM_FACTOR.sh
#73
hsantila
closed
5 years ago
0
Update center_n_calcFF.sh
#72
hsantila
closed
5 years ago
0
POPC deuterium OPs
#71
hsantila
closed
5 years ago
0
This script calculates Order Parameters of PDB files or gromacs traje…
#70
ohsOllila
closed
5 years ago
0
New indexing system
#69
ohsOllila
closed
3 years ago
2
Add files via upload
#68
hsantila
closed
5 years ago
0
Update calc_FORM_FACTOR.sh
#67
hsantila
closed
5 years ago
0
Updating bulk density calculation
#66
hsantila
closed
5 years ago
2
Quality measure for form factor from simulations
#65
ohsOllila
closed
1 year ago
2
Fitness code requires equal amount of order parameters from simulations and experiments
#64
ohsOllila
closed
1 year ago
2
centerTheBilayer script
#63
ohsOllila
closed
1 year ago
3
Chloride density for Berger POPS/POPC+CaCL mixture
#62
jsmaatta
closed
5 years ago
0
ADD LIPID17 FF
#61
peonqan
closed
5 years ago
0
This entry contains contradictory information about the system in title and descrtiption
#60
ohsOllila
opened
5 years ago
0
charmm36 and slipid ff
#59
peonqan
closed
5 years ago
2
Na cl500lipids
#58
peonqan
closed
5 years ago
1
Na cl500lipids
#57
peonqan
closed
5 years ago
1
Bulk density calculation in form factor script is erroneous
#56
hsantila
closed
1 year ago
5
Update calc_FORM_FACTOR.sh
#55
hsantila
closed
5 years ago
2
A script that centers the bilayer and calculates the form factor for arbitary number of molecular species
#54
hsantila
closed
5 years ago
2
Create mappingPOPCgaff.txt
#53
hsantila
closed
5 years ago
0
updating number densities for POPC:POPS (5:1) CaC2l ions Lipid17
#52
batukav
closed
5 years ago
0
updating number densities for POPC:POPS (5:1) CaCl2 ions Amber Lipid17
#51
batukav
closed
5 years ago
0
Wrong slice size in Form Factor script
#50
markussmiettinen
closed
1 year ago
1
The old version will be incorrect...
#49
markussmiettinen
closed
5 years ago
0
Create center_n_calcFF.sh
#48
hsantila
closed
5 years ago
0
Next