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* PyQt5: Update PyQt5 to 5.15.3, QScintilla2 to 2.12.0, py-qtbuilder to 1.9.0Loïc Bartoletti2021-03-082-0/+2
* Fix PLIST with hardcoded python versionSunpoet Po-Chuan Hsieh2021-03-071-2/+2
* Use shared OPENMPI_DESCSunpoet Po-Chuan Hsieh2021-03-071-1/+0
* Update to 2.7.3Sunpoet Po-Chuan Hsieh2021-03-072-6/+6
* Simplify MakefileSunpoet Po-Chuan Hsieh2021-03-071-11/+5
* Update to 2.43Sunpoet Po-Chuan Hsieh2021-03-072-4/+4
* Bump PORTREVISION for devel/grpc shlib changeSunpoet Po-Chuan Hsieh2021-03-071-1/+1
* science/jmol: Update 14.31.29 -> 14.31.34Yuri Victorovich2021-03-072-4/+4
* science/qbox: Remove unnecessary gcc link flags because the project builds wi...Yuri Victorovich2021-03-071-3/+4
* science/pagmo2: Update 2.16.1 -> 2.17.0Yuri Victorovich2021-03-064-6/+7
* science/py-pymatgen: Fix packaging with Python 3.8Kai Knoblich2021-03-061-3/+3
* science/py-pymatgen: Update 2021.3.3 -> 2022.0.3Yuri Victorovich2021-03-062-16/+16
* science/py-pymatgen: Update 2021.2.16 -> 2021.3.3Yuri Victorovich2021-03-052-17/+17
* science/afni: Update to 21.0.13Neel Chauhan2021-03-052-4/+4
* science/py-qcelemental: Update 0.18.0 -> 0.19.0Yuri Victorovich2021-03-052-4/+4
* Update KDE Release-Service releases to 20.12.3Tobias C. Berner2021-03-045-10/+52
* science/rdkit: Update 2020.09.4 -> 2020.09.5Yuri Victorovich2021-03-022-4/+4
* Set USES=mpi.Thierry Thomas2021-03-021-6/+6
* science/py-dipy: Fix pkg-plist issues with non-default Python versionsKai Knoblich2021-03-021-2/+2
* science/openbabel: Fix pkg-plist issues with non-default Python versionsKai Knoblich2021-03-021-6/+6
* science/agrum: Update 0.19.1 -> 0.19.2Yuri Victorovich2021-03-013-6/+6
* science/dakota: Fix build on i386Yuri Victorovich2021-03-012-6/+24
* - Update to 2.44TAKATSU Tomonari2021-03-012-4/+4
* science/afni: update to 21.0.12Fernando Apesteguía2021-03-013-4/+5
* Preparing for Python 3.8 (do not hardcode -37).Thierry Thomas2021-02-281-14/+14
* science/py-qcengine: Update 0.17.0 -> 0.18.0Yuri Victorovich2021-02-282-4/+4
* science/py-qcelemental: Update 0.17.0 -> 0.18.0Yuri Victorovich2021-02-282-5/+5
* science/py-pygmo2: Update 2.15.0-139 -> 2.16.1Yuri Victorovich2021-02-282-9/+17
* science/pagmo2: Update 2.15.0-102 -> 2.16.1Yuri Victorovich2021-02-283-14/+7
* science/shelxle: Update 1.0.1226 -> 1.0.1229Yuri Victorovich2021-02-272-4/+4
* science/sparta: Update 6Jul2020 -> 26Feb2021Yuri Victorovich2021-02-262-4/+4
* science/abinit: Update 9.2.2 -> 9.4.0Yuri Victorovich2021-02-262-5/+5
* science/qbox: 1.72.3 -> 1.73.1Yuri Victorovich2021-02-262-4/+4
* science/afni: update to 21.0.10Fernando Apesteguía2021-02-243-4/+5
* New port: science/libecpint: Library for the evaluation of integrals over eff...Yuri Victorovich2021-02-245-0/+77
* science/afni: Update to 21.0.09Neel Chauhan2021-02-232-4/+4
* science/dakota: Add port options GUI, HDF5, enable some more optional featuresYuri Victorovich2021-02-232-5/+30
* science/kst2:Max Brazhnikov2021-02-233-3/+25
* science/py-pymatgen: Update 2021.2.14 -> 2021.2.16Yuri Victorovich2021-02-222-4/+10
* science/py-veusz: Update 3.2.1 -> 3.3.1Yuri Victorovich2021-02-223-88/+10
* science/py-segyio: Update 1.9.5 -> 1.9.6Yuri Victorovich2021-02-222-4/+4
* science/segyio: Update 1.9.5 -> 1.9.6Yuri Victorovich2021-02-222-4/+4
* science/dakota: Add GSL optionYuri Victorovich2021-02-202-0/+10
* New port: science/dakota: Interface between analysis codes & iterative system...Yuri Victorovich2021-02-209-0/+2746
* Mark these ports as BROKEN: fail to fetch from mastersite.Mark Linimon2021-02-192-0/+3
* science/py-moltemplate: Update 2.19.5 -> 2.19.6Yuri Victorovich2021-02-192-4/+4
* science/gromacs: Update 2020.5 -> 2021Yuri Victorovich2021-02-183-8/+36
* science/agrum: Update 0.19.0 -> 0.19.1Yuri Victorovich2021-02-183-7/+6
* science/lammps: Update 24Dec2020 -> 10Feb2021Yuri Victorovich2021-02-183-4/+9
* Mark BROKEN in 13/14 (via latest llvm update).Mark Linimon2021-02-181-0/+3
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