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- .github/workflows/push.yml+51
- .gitignore+5
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- .travis.yml-49
- CHANGELOG.md+89-42
- CONTRIBUTING.md+16
- Makefile.am+1-1
- README.md+74-31
- configure.ac+207-188
- doc/doxy-main.md+161-87
- doc/doxygen-footer.html+1-17
- doc/man/freesasa.1.in+10-7
- m4/ax_cxx_compile_stdcxx.m4+951
- share/naccess.config+3-4
- share/oons.config+7-2
- share/protor.config+11
- src/Makefile.am+5-4
- src/cif.cc+817
- src/cif.hh+53
- src/classifier.c+302-191
- src/classifier.h+21-32
- src/classifier_naccess.c+87-75
- src/classifier_oons.c+58-46
- src/classifier_protor.c+126-114
- src/coord.c+105-101
- src/coord.h+56-70
- src/example.c+4-2
- src/freesasa.c+23-23
- src/freesasa.h+262-186
- src/freesasa_internal.h+114-89
- src/json.c+26-21
- src/log.c+41-42
- src/main.cc+195-142
- src/nb.c+168-123
- src/nb.h+6-6
- src/node.c+112-72
- src/pdb.c+83-83
- src/pdb.h+28-40
- src/rsa.c+20-20
- src/sasa_lr.c+101-98
- src/sasa_sr.c+53-55
- src/selection.c+198-167
- src/selection.h+18-9
- src/structure.c+232-163
- src/util.c+34-29
- src/xml.c+20-22
- tests/Makefile.am+4-4
- tests/compare-cif-pdb/.gitignore+4
- tests/compare-cif-pdb/AsyncResult.fs+11
- tests/compare-cif-pdb/Command.fs+42
- tests/compare-cif-pdb/Download.fs+20
- tests/compare-cif-pdb/Program.fs+189
- tests/compare-cif-pdb/README.md+9
- tests/compare-cif-pdb/compare-cif-pdb.fsproj+20
- tests/compare-cif-pdb/compare-cif-pdb.sln+34
- tests/data/1d3z.cif+13.3k
- tests/data/1sui.cif+10.2k
- tests/data/1sui.pdb+8.4k
- tests/data/1ubq.cif+1.5k
- tests/data/2isk.cif+19.6k
- tests/data/2isk.pdb+16.2k
- tests/data/2jo4.cif+12.4k
- tests/data/3bkr.cif+2.4k
- tests/data/3bkr.pdb+1.5k
- tests/data/3gnn.cif+6.1k
- tests/data/3gnn.pdb+4.5k
- tests/data/5dx9.cif+4.6k
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- tests/data/diverse_pdbs_2000.txt+2.0k
- tests/test-cli.in+104-18
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- tests/test_coord.c+64-56
- tests/test_freesasa.c+117-119
- tests/test_json.c+27-30
- tests/test_main.c+25-24
- tests/test_nb.c+27-23
- tests/test_node.c+13-7
- tests/test_pdb.c+84-72
- tests/test_selection.c+160-119
- tests/test_structure.c+146-140
- tests/test_xml.c+35-24
- tests/tools.c+3-3
- tests/tools.h+1
- third-party/gemmi+1
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