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2021-05-19RDKit: new package (#23761)Brian Van Essen1-0/+41
RDKit is a collection of cheminformatics and machine-learning software written in C++ and Python.
2021-05-19mpich: Apply fallow-argument-mismatch parameter with clang (#23748)David Hughes1-0/+2
2021-05-19py-pygeos: add v0.10 (#23781)Adam J. Stewart1-0/+3
2021-05-19py-qtpy: recipe bugfix (#23747)Valentin Volkl1-1/+1
2021-05-19gnupg: bumped versions, added maintainer (#23734)Massimiliano Culpo6-19/+49
2021-05-19py-jinja2: add version 2.11.3 (#23698)Andreas Baumbach1-0/+2
* py-jinja2: add version 2.11.3 Change-Id: If845ff512bafed4d911b03463cae2154357ae5c3 * fixup Change-Id: Ie39a8b7225826547fcbdb68cb083311a191903ef
2021-05-19TAU needs to specify pdt_c++ if built with intel. (#23775)wspear1-0/+2
2021-05-18upcxx: Add support for stand-alone post-install tests (#23714)Dan Bonachea1-0/+12
This uses the existing script which is always installed for this purpose in modern versions.
2021-05-18lmdb package: Fix build with other compilers (#23704)Michael Kuhn1-0/+4
lmdb hardcodes gcc in its Makefile, so override it.
2021-05-18mercurial: add version 5.8 (#23756)Robert Mijakovic1-0/+1
2021-05-18emacs: add version 27.2 (#23753)Robert Mijakovic1-0/+1
2021-05-18py-werkzeug: add versions including 0.15.6 (#23728)Andreas Baumbach1-0/+6
2021-05-18precice: Add version 2.2.1 (#23743)Frédéric Simonis1-0/+1
2021-05-18julia: new version, 1.6.1 (#23755)Robert Mijakovic1-0/+1
Co-authored-by: Robert Mijakovic <robert.mijakovic@lxp.lu>
2021-05-18New package: ca-certificates-mozilla (#23632)Harmen Stoppels1-0/+37
2021-05-18cppcheck: add versions including 2.0 and 1.88 (#23678)Andreas Baumbach1-0/+4
2021-05-18doxygen: fix build with gcc@10: for version 1.8.15 (#23680)Andreas Baumbach2-0/+34
2021-05-18trinity: Version Update to 2.12.0 (#23430)Desmond Orton1-0/+11
Added version requirements for deps Changed url to get proper versions
2021-05-18fontconfig: add version 2.13.93 (#23681)Andreas Baumbach1-0/+1
2021-05-18Swift/T Release 1.5.0 (#23702)Justin M Wozniak4-4/+10
Add versions to adlbx (1.0.0), exmcutils (0.6.0), stc (0.9.0), and turbine (1.3.0).
2021-05-18openspeedshop and cbtf packages: new versions and dependency updates (#23254)Jim Galarowicz11-197/+267
* Add versions 1.9.4 and 1.9.4.1 for cbtf-* packages * Add versions 2.4.2 and 2.4.2.1 for openspeedshop packages * Remove older versions * Switch from generic dependency on elf to a dependency on the elfutils implementation for cbtf-* and openspeedshop packages * For llvm-openmp-ompt, relax dependency on libelf to elf (cbtf-krell now depends on elfutils, and llvm-openmp-ompt, so unless this dependency is relaxed there would be a conflict) * Update CMake build_type to support Debug, Release, RelWithDebInfo in cbtf-* and openspeedshop packages * Update libmonitor patches when building as a dependency of cbtf-krell
2021-05-18AMD ROCm release 4.2: core components part-1 (#23613)arjun-raj-kuppala3-7/+19
2021-05-18git add older versions (#23682)Andreas Baumbach1-0/+10
2021-05-18cray: fix builds on Alps/Eiger (CSCS) (#23470)Harmen Stoppels4-6/+96
Co-authored-by: Tiziano Müller <tiziano.mueller@chem.uzh.ch>
2021-05-18binutils: fix NameError from commit de8027 (#23715)eugeneswalker1-1/+1
2021-05-18py-alembic: add new version 1.5.5 (#23686)Andreas Baumbach1-1/+4
* py-alembic: add new version 1.5.5 Change-Id: I80f57c1f29a689bfa1718dd3500ccda6623acf76 * fixup Change-Id: I551888c25ca7bc0b738c40d63d12974510b59ecf
2021-05-17Fix minor build issue with UnifyFS. (#23709)Ross Miller2-0/+44
This commit updates the UnifyFS package.py script to include a patch that fixes the build problems on new-ish Linux distributions. Fixes issue #23292
2021-05-17py-gitpython: add version 0.3.6 (#23695)Andreas Baumbach1-0/+1
Change-Id: I3424409f8a7575c6a13592c05e1e940f960fe8fe
2021-05-17New package: r-assertive (#23637)Jen Herting1-0/+38
2021-05-17py-jsonpickle: restrict importlib dependency to appropriate python (#23699)Andreas Baumbach1-1/+1
Change-Id: I538d72eb97d3cc91e2e6854b40c5b91b39df6f62
2021-05-17py-jedi: add older versions (#23697)Andreas Baumbach1-0/+12
Change-Id: I56de34bace2fb04156700ffd4f1b34408920d702
2021-05-17py-grpcio: add version 1.16.0 (#23696)Andreas Baumbach1-0/+1
Change-Id: I4acb232e171ddec688eb7871da80caaa05bf637b
2021-05-17py-google-pasta: add older versions (#23694)Andreas Baumbach1-0/+8
Change-Id: I5846415b4953a5f12f995672e586cadb80857db2
2021-05-17py-astroid: add new versions and update dependencies (#23687)Andreas Baumbach2-2/+140
Change-Id: I2c07e75b404ec289feebdbfb09f6b0e733404911
2021-05-17CrayPE fix for axom (#23520)lukebroskop1-0/+9
Pass -ef to the cce fortran compiler, fix the build system to use the correct openmp flag for CCE Co-authored-by: Tamara Dahlgren <35777542+tldahlgren@users.noreply.github.com>
2021-05-17py-bottleneck: add new versions (#23689)Andreas Baumbach1-0/+3
Change-Id: I31a22fa1495cc2ceed33ba7084831c11120c03e7
2021-05-17ParaView: add new release v5.9.1 (#23657)Vicente Bolea1-3/+2
2021-05-17CrayPE fixes for the slepc package (#23503)lukebroskop1-1/+5
Use the gold linker for CCE (this may change later) Co-authored-by: Tamara Dahlgren <35777542+tldahlgren@users.noreply.github.com>
2021-05-17ArborX: Avoid calling mkdirp directly (#23691)Daniel Arndt1-2/+1
2021-05-17py-coverage: add version and restrict newer python dependency (#23692)Andreas Baumbach1-0/+2
Change-Id: I7e790014fd448eb203a1963c90e22afde041ba50
2021-05-17CrayPE fix for binutils (#23500)lukebroskop1-1/+8
Allow for multiple definitions at link time (for CrayPE) Co-authored-by: Tamara Dahlgren <35777542+tldahlgren@users.noreply.github.com> Co-authored-by: Harmen Stoppels <harmenstoppels@gmail.com>
2021-05-17CrayPE fix for trilinos (#23518)lukebroskop1-1/+7
Expand the use of cray_secas.patch and use the gold linker w/cce Co-authored-by: Tamara Dahlgren <35777542+tldahlgren@users.noreply.github.com>
2021-05-17craype fixes for scr (#23510)lukebroskop1-1/+9
turn off static linking, add -ldl flag Co-authored-by: Tamara Dahlgren <35777542+tldahlgren@users.noreply.github.com>
2021-05-17libfuse: add 3.10.3 (#23676)Michael Kuhn1-0/+2
This also adds a patch to make libfuse compile with gcc@11:
2021-05-17trilinos: add scorec variant (#23117)Bryan Herman1-0/+15
* add scorec feature to trilinos recipe * used func to enable SCOREC
2021-05-17ccache: add v4.3 (#23671)Harmen Stoppels1-0/+1
2021-05-17aws-parallelcluster: add v2.10.4 (#23672)Enrico Usai1-3/+3
2021-05-17c-blosc2: new version, v2.0.0rc1 (#23560)Robert Mijakovic1-0/+2
2021-05-17bib2xhtml: add dependency to run bibtex (#22742)darmac1-0/+2
2021-05-17openfoam: update to OpenFOAM-v2012_210414 (patch release) (#23249)Mark Olesen1-1/+3
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