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Release 3.2.0

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@josemduarte josemduarte released this 20 Feb 01:09
· 416 commits to master since this release
  • mmseqs2 replaces blast in sequence search for precomputation, dramatically reducing time needed for PDB precomputation #46
  • mmseqs2 replaces blastclust for redundancy elimination clustering. Removes blastclust dependency
  • a single run of redundancy elimination with clustering at 90% seq id is now used (instead of incrementally trying different sequence identities)
  • extracted utils into new module eppic-util
  • pdb to uniprot reference alignment now strictly from SIFTS #188
  • all insertion/deletions are now not considered for evolutionary analysis
  • no evolutionary analysis performed for peptides (30 default length cutoff). Solves #9, #5
  • keeps blastp for user jobs. Mmseqs is not fast for single jobs (unless setup with a server holding the indices in memory)
  • user jobs use uniprot japi instead of local uniprot db
  • sequence search cache (before blast cache) is now in db (via JPA)
  • local uniprot db is now interfaced via JPA instead of raw sql. DB interface now fully JPA
  • improvements in precomputation scripts to support mmseqs