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* science/step: pet stage-qaDima Panov2022-09-051-1/+3
* science/kalzium: pet stage-qaDima Panov2022-09-051-2/+3
* science/serac: New port: High order nonlinear thermomechanical simulation codeYuri Victorovich2022-09-057-0/+189
* science/opsin: Fix build on aarch64Yuri Victorovich2022-09-041-0/+2
* science/py-hoomd-blue: Update 3.2.0 -> 3.4.0; Add MPI optionsYuri Victorovich2022-09-043-20/+36
* science/afni: update to 22.2.10Fernando Apesteguía2022-09-043-5/+10
* science/libkml: Revert 71a4cedd0383a76f847f0fa1ab32b9209df20959Po-Chuan Hsieh2022-09-0413-16/+120
* science/py-gsd: Update 2.5.3 -> 2.6.0Yuri Victorovich2022-09-042-5/+5
* science/axom: Update 0.6.1-1671 -> 0.7.0Yuri Victorovich2022-09-042-15/+13
* science/py-pyscf: Update 2.0.1 -> 2.1.0Yuri Victorovich2022-09-042-14/+11
* science/afni: update to 22.2.09Fernando Apesteguía2022-09-022-4/+4
* math/dbcsr: Update 2.3.0 -> 2.4.1Yuri Victorovich2022-09-021-0/+1
* science/py-MDAnalysisTests: Update 2.2.0 -> 2.3.0Yuri Victorovich2022-09-022-8/+5
* science/py-MDAnalysis: Update 2.2.0 -> 2.3.0Yuri Victorovich2022-09-022-11/+7
* science/py-qiskit-finance: Update 0.3.3.20220816 -> 0.3.4Yuri Victorovich2022-09-022-4/+4
* science/py-pygeometa: Update to 0.12.0Po-Chuan Hsieh2022-08-312-4/+4
* science/py-eccodes: Update to 1.5.0Po-Chuan Hsieh2022-08-312-4/+4
* science/eccodes: Update to 2.27.0Po-Chuan Hsieh2022-08-312-4/+4
* science/{,py-}pyprecice: Update 2.4.0.0 -> 2.5.0.0Yuri Victorovich2022-08-315-23/+15
* science/py-pyteomics: Update to 4.5.5Po-Chuan Hsieh2022-08-312-4/+4
* science/py-asdf-transform-schemas: Update to 0.3.0Po-Chuan Hsieh2022-08-313-6/+62
* science/py-asdf-standard: Update to 1.0.3Po-Chuan Hsieh2022-08-313-7/+56
* science/py-asdf: Update to 2.13.0Po-Chuan Hsieh2022-08-313-6/+75
* science/liblinear: Update to 2.45Po-Chuan Hsieh2022-08-312-4/+4
* science/libkml: Update to newer snapshot (916a801)Po-Chuan Hsieh2022-08-3113-113/+18
* science/cdo: Update to 2.0.6Po-Chuan Hsieh2022-08-314-16/+18
* science/py-scimath: Update to 5.0.0Wen Heping2022-08-292-5/+5
* science/conduit: Update 0.8.3 -> 0.8.4Yuri Victorovich2022-08-283-5/+5
* science/libcint: Update 5.1.3 -> 5.1.6Yuri Victorovich2022-08-282-4/+4
* science/afni: update to 22.2.08Fernando Apesteguía2022-08-283-4/+11
* science/dwave-preprocessing: New port: DWave: Preprocessing tools to aid in s...Yuri Victorovich2022-08-287-0/+99
* science/dimod: Fix testsYuri Victorovich2022-08-275-2/+54
* science/libkml: Remove unneeded googletestPo-Chuan Hsieh2022-08-271-5/+4
* science/py-pysal: Update to 2.7.0Po-Chuan Hsieh2022-08-272-11/+11
* science/pnetcdf: Remove outdated post-patch:Po-Chuan Hsieh2022-08-271-7/+4
* science/dimod: Remove unnecessary USES; Minor correctionsYuri Victorovich2022-08-271-4/+2
* science/dimod: New port: DWave: Shared API for QUBO/Ising samplersYuri Victorovich2022-08-274-0/+51
* science/sirius: New port: Domain specific library for electronic structure ca...Yuri Victorovich2022-08-275-0/+229
* science/nlcglib: New port: Nonlinear CG methods for wave-function optimizatio...Yuri Victorovich2022-08-275-0/+52
* science/jmol: Unbreak by switching to Java 17Yuri Victorovich2022-08-251-0/+2
* rust: bring back update to 1.63Baptiste Daroussin2022-08-251-1/+1
* Revert "lang/rust: Bump revisions after 1.63.0"Piotr Kubaj2022-08-251-1/+1
* lang/rust: Bump revisions after 1.63.0Mikael Urankar2022-08-251-1/+1
* science/py-qiskit: Update 0.37.1-4 -> 0.37.2Yuri Victorovich2022-08-252-6/+4
* science/cardioid: New port: Cardiac simulation toolkitYuri Victorovich2022-08-246-0/+106
* science/py-dwave-samplers: Add testsYuri Victorovich2022-08-232-7/+10
* science/axom: Fix typoYuri Victorovich2022-08-231-1/+1
* science/ascent: Fix MPI, add MPI options NOMPI, MPICH, OPENMPIYuri Victorovich2022-08-232-2/+18
* science/axom: Add option group MPI with options NOMPI,MPICH,OPENMPIYuri Victorovich2022-08-232-21/+30
* science/conduit: Add MPI options NOMPI,MPICH,OPENMPI; Change defaultYuri Victorovich2022-08-232-17/+29
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