 ../
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data/
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1293
(11 years ago)
by jmduarteg:
Now parsing experimental method, resolution, R free and R sym.
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AminoAcidTest.java
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1008
(12 years ago)
by hstehr:
refactoring: adapting test packages to match new package structure
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PdbAsymUnitTest.java
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1296
(11 years ago)
by jmduarteg:
Bringing back the PISA classes for interface, molecule and residues. We store things first into them and only then convert to our own ChainInterface if needed. This is a much better approach less prone to errors. Tests pass.
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PdbParsersTest.java
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1293
(11 years ago)
by jmduarteg:
Now parsing experimental method, resolution, R free and R sym.
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PdbTest.java
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1252
(11 years ago)
by jmduarteg:
Implemented some parallelisation in ASA calculation. It doesn't scale very well (could measure x2 speed-up with 4 CPUs in a Core2 Quad) but at least we have it, now this is starting to be better than NACCESS!
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SpaceGroupTest.java
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1269
(11 years ago)
by jmduarteg:
Fixed bug in SpaceGroupTest. Now it works and test passes.
Introduced checking for clashes in interfaces. Added it to the PdbAsymUnitTest
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