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mittinatten
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freesasa
C-library for calculating Solvent Accessible Surface Areas
http://freesasa.github.io/
MIT License
103
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37
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Support CIF
#51
mittinatten
closed
3 years ago
16
How to prohibit FreeSASA warning
#50
xiaolinpan
closed
3 years ago
5
read from pdb block
#49
xiaolinpan
closed
3 years ago
5
Support for CIF format
#48
danny305
closed
3 years ago
51
Running setup.py install for freesasa ... error
#47
liuxue-123
closed
4 years ago
2
xml.c:4:10: fatal error: 'libxml/tree.h' file not found
#46
alabrashJr
closed
4 years ago
6
Compile Error on PIP
#45
Gab0
closed
4 years ago
6
Installation issue
#44
sjkdenny
closed
5 years ago
6
About using '--chain-groups' in the command line.
#43
YoochanMyung
closed
5 years ago
4
Trying to use freesasa on each file in a folder of 3,311 .pdb1 files, works individually but shows reading error when using os.listdir.
#42
emroberts95
closed
5 years ago
6
Wrong SASA after setting different atom radius
#41
fabiotrovato
closed
5 years ago
17
Can I use freesasa to calculate the SASA for a 3D small molecules?
#40
chengthefang
closed
5 years ago
2
freesasa.Structure needs a .insertionCode() method
#39
jaredsagendorf
closed
5 years ago
5
I failed to make it
#38
ProzacR
closed
5 years ago
2
Change README.md? Compiling 2.0.3 in Ubuntu
#37
pgbarletta
closed
6 years ago
2
Generate Surface map (mesh)?
#36
paconius
closed
6 years ago
2
Hydrogens wrongly supported when using Bio.PDB
#35
mtrellet
closed
3 years ago
2
Deploying freeSASA python library through PyPi or Anaconda
#34
molsim
closed
6 years ago
27
Removing false positive detection of H-atoms
#33
arghya90
closed
6 years ago
4
Allow selection of ranges of inserted residues
#32
mittinatten
opened
6 years ago
1
Set residue reference SASA through configuration file
#31
mittinatten
opened
6 years ago
1
Inserted residues
#30
OlekKuriata
closed
6 years ago
3
Fixes forced libxml dependency
#29
bp-kelley
closed
6 years ago
13
Replaced PDB files by those used to calibrate NACCESS relative accessibilities
#28
JoaoRodrigues
closed
6 years ago
4
Relative Accessibilities
#27
JoaoRodrigues
closed
6 years ago
14
calcCoord
#26
npolizzi
closed
6 years ago
2
Problems with PDB output using --separate-models
#25
mittinatten
closed
6 years ago
3
FreeSasa unable to analyze nmr structures of RNA
#24
drjsoundsgood
closed
7 years ago
4
Python3 again.
#23
npolizzi
closed
7 years ago
6
Windows compatibility
#22
mittinatten
closed
6 years ago
22
python bindings under windows
#21
vlado-s
closed
6 years ago
7
Python3 & Cython3
#20
vlado-s
closed
7 years ago
5
New minor release
#19
molsim
closed
7 years ago
3
compilation of python-bindings on ubuntu
#18
molsim
closed
7 years ago
4
Classifier for hydrogen atoms might be not working
#17
molsim
closed
7 years ago
8
Selection syntax issues
#16
molsim
closed
7 years ago
23
Cython not found with --enable-python-bindings
#15
jaredsagendorf
closed
7 years ago
6
Add support for numpy arrays
#14
mittinatten
closed
7 years ago
1
No configure script provided
#13
dww100
closed
7 years ago
1
option to read in radii via PDB occupancies?
#12
demianriccardi
closed
8 years ago
7
Any chance you'd consider an alternate license?
#11
greglandrum
closed
8 years ago
5
Added rules to distribute share/ directory on 'make install'
#10
JoaoRodrigues
closed
8 years ago
2
(More) Compilation & Configuration Errors
#9
JoaoRodrigues
closed
8 years ago
6
Added share folder to hold config files. Included NACCESS configs
#8
JoaoRodrigues
closed
8 years ago
1
Compilation Warning: check not found
#7
JoaoRodrigues
closed
8 years ago
4
Proper check for PDB format
#6
JoaoRodrigues
closed
8 years ago
11
Read Parameters from External File
#5
JoaoRodrigues
closed
8 years ago
22
Make CLI as GNU compatible as possible
#4
mittinatten
closed
8 years ago
1
Error handling
#3
mittinatten
closed
8 years ago
2
GNU Getline
#2
mittinatten
closed
9 years ago
1
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