 ../
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data/
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1218
(11 years ago)
by jmduarteg:
Fixed bug: was null pointing in parsing NMR cif files because they don't have crystal parameter fields. Now skipping that properly. Added NMR test entry to test cases.
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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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PdbTest.java
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1029
(12 years ago)
by jmduarteg:
Fixed hard-coded resources paths broken since major restructuring of project.
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PdbAsymUnitTest.java
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1217
(11 years ago)
by jmduarteg:
First fully working version (this time hopefully for real...) of interface enumeration. Works for many examples, still there are problems in many others due to area discrepancies with pisa, but those are minor things. The elimination of duplicates is based on chain codes and number of contacting atoms, it is of course possible that 2 different interfaces happen to have the same chain codes and same number of contacting atoms (but unlikely). Would need a more fine grained comparison.
New test class to compare automatically to PISA output.
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PdbParsersTest.java
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1218
(11 years ago)
by jmduarteg:
Fixed bug: was null pointing in parsing NMR cif files because they don't have crystal parameter fields. Now skipping that properly. Added NMR test entry to test cases.
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