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freebsd-ports/science/xtb/pkg-plist

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new port: science/xtb xtb is a semiempirical extended tight-binding program package with application in computational chemistry and matrials science. Port is configured to use OpenBLAS to facilitate performance. WWW: https://github.com/grimme-lab/xtb
2020-05-29 00:05:42 +02:00
bin/xtb
science/xtb: update to 6.3.3 Bugfixes in models and compiler support. Changelog: https://github.com/grimme-lab/xtb/releases/tag/v6.3.3
2020-09-20 23:19:02 +02:00
include/xtb.h
lib/cmake/xtb/xtbConfig.cmake
lib/cmake/xtb/xtbConfigVersion.cmake
lib/cmake/xtb/xtbTargets-%%CMAKE_BUILD_TYPE%%.cmake
lib/cmake/xtb/xtbTargets.cmake
new port: science/xtb xtb is a semiempirical extended tight-binding program package with application in computational chemistry and matrials science. Port is configured to use OpenBLAS to facilitate performance. WWW: https://github.com/grimme-lab/xtb
2020-05-29 00:05:42 +02:00
lib/libxtb.a
lib/libxtb.so
science/xtb: update to 6.3.3 Bugfixes in models and compiler support. Changelog: https://github.com/grimme-lab/xtb/releases/tag/v6.3.3
2020-09-20 23:19:02 +02:00
lib/libxtb.so.6
science/xtb: update to 6.4.1
2021-11-27 18:49:53 +01:00
lib/libxtb.so.6.4.1
new port: science/xtb xtb is a semiempirical extended tight-binding program package with application in computational chemistry and matrials science. Port is configured to use OpenBLAS to facilitate performance. WWW: https://github.com/grimme-lab/xtb
2020-05-29 00:05:42 +02:00
%%DATADIR%%/.param_gfnff.xtb
%%DATADIR%%/param_gfn0-xtb.txt
%%DATADIR%%/param_gfn1-xtb.txt
%%DATADIR%%/param_gfn2-xtb.txt
%%DATADIR%%/param_ipea-xtb.txt
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