aboutsummaryrefslogtreecommitdiff
path: root/science
Commit message (Expand)AuthorAgeFilesLines
* PyQt: Update sip to 6.5.0, reintroduce sip4 and simplify PyQt framework.Loïc Bartoletti2022-01-275-13/+9
* science/ascent: Update 0.7.1 -> 0.7.1-66Yuri Victorovich2022-01-263-5/+20
* science/py-moltemplate: Update 2.20.1 -> 2.20.2Yuri Victorovich2022-01-262-4/+4
* science/rubygem-rgeo: Update to 2.4.0Po-Chuan Hsieh2022-01-252-4/+4
* science/py-libpysal: Update to 4.6.0Po-Chuan Hsieh2022-01-252-5/+7
* science/py-geometer: Update to 0.3.1Po-Chuan Hsieh2022-01-252-4/+4
* science/eccodes: Update to 2.24.2Po-Chuan Hsieh2022-01-252-4/+4
* science/lammps: Update 29Sep2021 -> 7Jan2022Yuri Victorovich2022-01-253-11/+23
* science/yoda: Update 1.9.1 -> 1.9.4Yuri Victorovich2022-01-253-6/+14
* science/afni: update to 22.0.03Fernando Apesteguía2022-01-253-7/+8
* science/votca: Fix testsYuri Victorovich2022-01-252-2/+7
* archivers/minizip*: Add minizip-ng and zlib-ng and create USES=minizipLoïc Bartoletti2022-01-251-4/+2
* science/py-moltemplate: Update 2.19.14 -> 2.20.1Yuri Victorovich2022-01-252-4/+7
* science/py-chainer: Update 7.8.0 -> 7.8.1Yuri Victorovich2022-01-252-5/+4
* science/votca: Update 2021.2-18560 -> 2022Yuri Victorovich2022-01-243-1806/+11
* science/simple-dftd3: Update 0.5.0 -> 0.5.1Yuri Victorovich2022-01-243-7/+6
* science/jmol: Update 14.32.14 -> 14.32.16Yuri Victorovich2022-01-243-4/+5
* science/py-fresnel: New port: Publication quality path tracing in real timeYuri Victorovich2022-01-246-0/+196
* science/py-hoomd-blue: Fix fetchYuri Victorovich2022-01-232-5/+2
* science/py-spaghetti: Update to 1.6.5Po-Chuan Hsieh2022-01-232-4/+4
* science/py-geometer: Update to 0.3.0Po-Chuan Hsieh2022-01-233-17/+5
* science/py-cdo: Update to 1.5.6Po-Chuan Hsieh2022-01-233-5/+4
* science/eccodes: Update to 2.24.0Po-Chuan Hsieh2022-01-233-4/+671
* science/cdo: Update to 2.0.3Po-Chuan Hsieh2022-01-233-5/+7
* science/rdkit: Broken on i386Yuri Victorovich2022-01-221-0/+2
* science/py-hoomd-blue: Backport patch supporting latest cereal.Yuri Victorovich2022-01-224-23/+6
* science/py-hoomd-blue: New port: Molecular dynamics and Monte Carlo soft matt...Yuri Victorovich2022-01-217-0/+1061
* science/py-gsd: Update 2.5.0 -> 2.5.1Yuri Victorovich2022-01-212-4/+4
* science/jmol: Update 14.32.13 -> 14.32.14Yuri Victorovich2022-01-203-5/+5
* science/shelxle: Update 1.0.1354 -> 1.0.1356Yuri Victorovich2022-01-202-4/+4
* science/chimes-calculator: New port: Chebyshev Interaction Model for Efficien...Yuri Victorovich2022-01-195-0/+62
* */*: In 7 ports remove GNU-10.3.0 from install pathsYuri Victorovich2022-01-1812-202/+226
* science/thermofun: Update 0.3.8 -> 0.3.9Yuri Victorovich2022-01-183-6/+5
* science/chemicalfun: New port: C++ library for working with chemical reaction...Yuri Victorovich2022-01-185-0/+46
* science/jmol: Update 14.32.10 -> 14.32.13Yuri Victorovich2022-01-183-5/+11
* science/mctc-lib: Update 0.2.3 -> 0.2.4Yuri Victorovich2022-01-183-5/+8
* science/tblite: New port: Light-weight tight-binding frameworkYuri Victorovich2022-01-185-0/+159
* science/simple-dftd3: New port: Reimplementation of the DFT-D3 programYuri Victorovich2022-01-185-0/+73
* science/libnegf: Add options; Correct licenseYuri Victorovich2022-01-171-3/+14
* *: Clean up some thingsTobias Kortkamp2022-01-172-3/+3
* science/libnegf: New port: Non Equilibrium Green's Functions libraryYuri Victorovich2022-01-175-0/+73
* science/libmbd: New port: Many-body dispersion libraryYuri Victorovich2022-01-175-0/+55
* science/dftbplus: Fix testsYuri Victorovich2022-01-162-9/+11
* science/dftbplus: Update 19.1 -> 21.2Yuri Victorovich2022-01-168-184/+564
* science/gromacs: Update 2021.4 -> 2021.5Yuri Victorovich2022-01-152-4/+4
* science/rdkit: Update 2021.03.5 -> 2021.09.4Yuri Victorovich2022-01-153-18/+18
* science/py-pymatgen: Update 2022.0.15 -> 2022.0.17Yuri Victorovich2022-01-142-9/+9
* science/py-phonopy: Update 2.11.0 -> 2.12.0Yuri Victorovich2022-01-142-4/+4
* science/qbox: 1.73.3 -> 1.74.1Yuri Victorovich2022-01-142-4/+5
* science/py-quantities: Update 0.12.5 -> 0.13.0Yuri Victorovich2022-01-142-7/+7