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Commits on May 16, 2022

• sci-chemistry/openbabel: [QA] use tc-check-openmp correctly

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Commits on May 14, 2022

• sci-chemistry/tinker: [QA] tc-has-openmp → tc-check-openmp

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• sci-chemistry/gromacs: [QA] tc-has-openmp → tc-check-openmp

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Commits on Apr 28, 2022

• sci-chemistry/gromacs: dropped unused eclass

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• sci-chemistry/gromacs: add 2022.1

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Commits on Apr 24, 2022

• sci-chemistry/gelemental: add 2.0.1

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Commits on Apr 15, 2022

• sci-chemistry/openbabel: Resurect opebabel[python]

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Commits on Apr 8, 2022

• sci-chemistry/modeller: enable py3.10

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• sci-chemistry/pymol: enable py3.10

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Commits on Apr 5, 2022

• sci-chemistry/openbabel-perl: Remove last-rited package

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Commits on Mar 30, 2022

• sci-chemistry/votca-ctp: Remove last-rited package

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Commits on Mar 28, 2022

• sci-chemistry/mm-align: treeclean

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Commits on Mar 20, 2022

• sci-chemistry/procheck: [QA] fix tc-get* quoting

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• sci-chemistry/mustang: [QA] fix tc-get* quoting

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• sci-chemistry/mopac7: [QA] fix tc-get* quoting

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• sci-chemistry/moldy: [QA] fix tc-get* quoting

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• sci-chemistry/gperiodic: [QA] fix tc-get* quoting

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Commits on Mar 17, 2022

• sci-chemistry/dssp: Keyword 4.0.4 x86, #834864

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Commits on Mar 13, 2022

• sci-chemistry/dssp: Bump to 4.0.4

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Commits on Mar 10, 2022

• sci-chemistry/openbabel: fix WhitespaceFound

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Commits on Mar 7, 2022

• sci-chemistry/openbabel: Drop 2.4.1-r2

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• sci-chemistry/openbabel: Stabilize 3.1.1_p20210225 x86, #834115

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• sci-chemistry/openbabel: Stabilize 3.1.1_p20210225 amd64, #834115

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Commits on Mar 6, 2022

• sci-chemistry/tm-align: Drop 20150914 (r0)

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• sci-chemistry/tm-align: x86 stable wrt bug #834302

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• sci-chemistry/tm-align: ppc64 stable wrt bug #834302

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• sci-chemistry/tm-align: amd64 stable wrt bug #834302

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Commits on Mar 5, 2022

• sci-chemistry/avogadro2: Drop 1.93.0

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Commits on Mar 4, 2022

• sci-chemistry/avogadro2: add version 1.95.1

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Commits on Mar 1, 2022

• sci-chemistry/votca-csg: Drop 1.5.1

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• sci-chemistry/votca-csgapps: Drop 1.5.1

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Commits on Feb 27, 2022

• sci-chemistry/tm-align: update EAPI 6 -> 8

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• sci-chemistry/pdbmat: port to EAPI 8

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• sci-chemistry/pdbcat: port to EAPI 8

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Commits on Feb 24, 2022

• sci-chemistry/molsketch: add some new deps required for new 0.7.2 version

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