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03'>Sort SUBDIRsSunpoet Po-Chuan Hsieh2021-02-071-1/+1 * New port: science/thermofun: Code for calculating thermodynamic properties of...Yuri Victorovich2021-02-021-0/+1 * Remove expired ports:Rene Ladan2021-02-011-1/+0 * New port: science/py-nilearn: Statistical learning for neuroimaging in PythonYuri Victorovich2021-01-211-0/+1 * New port: science/py-dipy: Python toolbox for analysis of MR diffusion imagingYuri Victorovich2021-01-211-0/+1 * New port: science/py-nibabel: Read/write some common neuroimaging file formatsYuri Victorovich2021-01-211-0/+1 * Remove expired ports:Rene Ladan2021-01-171-1/+0 * New port: science/shelxle: Graphical user interface for small-molecule struct...Yuri Victorovich2021-01-151-0/+1 * Add py-tobler 0.5.4Sunpoet Po-Chuan Hsieh2021-01-041-0/+1 * Add py-spaghetti 1.4.2Sunpoet Po-Chuan Hsieh2021-01-041-0/+1 * Add py-segregation 1.4.0Sunpoet Po-Chuan Hsieh2021-01-041-0/+1 * Add py-libpysal 4.3.0Sunpoet Po-Chuan Hsieh2021-01-041-0/+1 * Add py-inequality 1.0.0Sunpoet Po-Chuan Hsieh2021-01-041-0/+1 * Add py-esda 2.3.1Sunpoet Po-Chuan Hsieh2021-01-041-0/+1 * Add py-access 1.1.3Sunpoet Po-Chuan Hsieh2021-01-041-0/+1 * Remove expired ports not depending on Python 2.7:Rene Ladan2020-12-311-1/+0 * Adding jupyter-jsmol, a JSmol viewer widget for Jupyter Notebooks andThierry Thomas2020-12-221-0/+1 * Add py-eccodes 1.0.0 (copied from py-eccodes-python)Sunpoet Po-Chuan Hsieh2020-12-201-0/+1 * Add py-netcdf-flattener 1.2.0Sunpoet Po-Chuan Hsieh2020-12-111-0/+1 * Remove expired ports:Rene Ladan2020-12-021-1/+0 * Upgrade Code_Aster to 14.6.0-1.Thierry Thomas2020-11-271-0/+1 * New port: science/py-segyio: Python binding for segyio, the seismic data libraryYuri Victorovich2020-11-081-0/+1 * New port: science/segyio: Library to interact with SEG-Y & Seismic Unix forma...Yuri Victorovich2020-11-081-0/+1 * New port: science/axom: Infrastructure for development of multi-physics appli...Yuri Victorovich2020-10-091-0/+1 * New port: science/conduit: Simplified data exchange for HPC simulationsYuri Victorovich2020-10-091-0/+1 * Remove expired ports:Rene Ladan2020-09-191-2/+0 * New port: science/py-geometric: Geometry optimization for quantum chemistryYuri Victorovich2020-09-141-0/+1 * Remove expired ports:Rene Ladan2020-08-271-2/+0 * Remove deprecated ports:Rene Ladan2020-08-151-3/+0 * New port: science/py-pygmo2: Python platform to perform parallel computations...Yuri Victorovich2020-06-101-0/+1 * Clean up some thingsTobias Kortkamp2020-05-301-1/+1 * new port: science/xtbJohannes M Dieterich2020-05-291-0/+1 * New port: science/fastjet: Package for jet finding in pp and e+e- collisionsYuri Victorovich2020-05-271-0/+1 * New port: science/hepmc3: Event record for High Energy Physics Monte Carlo ge...Yuri Victorovich2020-05-271-0/+1 * Re-add port: science/cp2k: Quantum chemistry and solid state physics software...Yuri Victorovich2020-05-201-0/+1 * Re-add port: science/abinit: Full-featured atomic-scale first-principles simu...Yuri Victorovich2020-05-191-0/+1 * Add py-liac-arff 2.4.0Sunpoet Po-Chuan Hsieh2020-05-161-0/+1 * New port: science/py-moltemplate: Tool to prepare simulations of molecules, c...Yuri Victorovich2020-05-151-0/+1 * New port: science/ergo: Quantum chemistry program for large-scale atomic calc...Yuri Victorovich2020-05-141-0/+1 * Remove expired ports:Rene Ladan2020-05-051-7/+0 * SortTobias Kortkamp2020-05-051-1/+1 * New port: science/votca: CSG and XTP: libraries for atomistic simulationsYuri Victorovich2020-05-051-0/+1 * New port: science/plumed: PLUgin for MolEcular DynamicsYuri Victorovich2020-05-051-0/+1 * New port: science/py-kliff: KIM-based Learning-Integrated Fitting FrameworkYuri Victorovich2020-05-041-0/+1 * New port: science/py-kim-query: Helper routines for querying the OpenKIM repo...Yuri Victorovich2020-05-041-0/+1 * Add py-scikit-optimize 0.7.4Sunpoet Po-Chuan Hsieh2020-04-221-0/+1 * science/ncnn: Move to misc/ncnn; Update 20200226 -> 20200413Yuri Victorovich2020-04-141-1/+0 * New port: science/qiskit-aer: Simulator for quantum circuits, including noise...Yuri Victorovich2020-03-121-0/+1 * Remove expired ports, all Python-2.7-only:Rene Ladan2020-02-231-2/+0 * Adding R-cran-FAdist, a R package with a collection of probability distributionsThierry Thomas2020-01-291-0/+1 * Remove expired ports:Rene Ladan2020-01-271-5/+0 * New port: science/py-h5json: Tools and library for representing HDF5 in JSONYuri Victorovich2020-01-261-0/+1 * Add py-pygeometa 0.5.0Sunpoet Po-Chuan Hsieh2020-01-191-0/+1 * Add py-pycsw 2.4.2Sunpoet Po-Chuan Hsieh2020-01-191-0/+1 * Add py-geolinks 0.2.0Sunpoet Po-Chuan Hsieh2020-01-191-0/+1 * Move cad/elmerfem -> science/elmerfemYuri Victorovich2020-01-161-0/+1 * Remove expired ports:Rene Ladan2020-01-111-1/+0 * New port: science/cdk: Chemistry Development KitYuri Victorovich2020-01-101-0/+1 * Resurrect ports depending on devel/openmp.Rene Ladan2020-01-011-0/+3 * Remove expired ports:Rene Ladan2020-01-011-3/+0 * Add py-geomet 0.2.1Sunpoet Po-Chuan Hsieh2019-12-291-0/+1 * New port: science/highfive: Header-only C++ HDF5 interfaceYuri Victorovich2019-11-031-0/+1 * Remove deprecated portsNiclas Zeising2019-11-011-1/+0 * Remove expired ports:Rene Ladan2019-10-161-1/+0 * science/packmol: Pack molecules in defined regions of spaceJason W. Bacon2019-09-231-0/+1 * Sort SUBDIRsSunpoet Po-Chuan Hsieh2019-08-311-1/+1 * Move science/py-onnx -> math/py-onnxYuri Victorovich2019-08-271-1/+0 * New port: science/py-tensorflow-estimator: TensorFlow Estimator, an API to si...Yuri Victorovich2019-08-131-0/+1 * New port: science/py-chainer-chemistry: Library for deep learning in biology ...Yuri Victorovich2019-08-091-0/+1 * New port: science/py-chainer: Deep learning frameworkYuri Victorovich2019-08-091-0/+1 * New port: science/py-onnx: Open Neural Network eXchangeYuri Victorovich2019-08-091-0/+1 * Re-add science/py-tensorflow: Computation using data flow graphs for scalable...Yuri Victorovich2019-08-061-0/+1 * Hook up science/openkim-models to build.Yuri Victorovich2019-08-031-0/+1 * New port: science/ncnn: High-performance neural network inference frameworkYuri Victorovich2019-07-211-0/+1 * New port: science/wwplot: Plotting tool for experimental physics classesYuri Victorovich2019-07-211-0/+1 * New port: science/kim-api: Framework for reliable, reproducible, portable mol...Yuri Victorovich2019-07-201-0/+1 * New port: science/py-ruffusKai Knoblich2019-07-121-0/+1 * Remove dupplicate port.Mathieu Arnold2019-06-281-1/+0 * New port: science/molden: Program for molecular and electronic structure visu...Yuri Victorovich2019-06-281-0/+1 * New port: science/smoldyn: Biochemical simulator for molecular diffusion, sur...Yuri Victorovich2019-06-091-0/+1 * New port: science/opensph: Library and graphical tools for running SPH and N-...Yuri Victorovich2019-05-261-0/+1 * Add py-eccodes-python 0.9.0Sunpoet Po-Chuan Hsieh2019-05-261-0/+1 * New port: science/libvdwxc: Van der Waals density functional (DFT) libraryYuri Victorovich2019-05-181-0/+1 * New port: science/simgrid: Simulator of the behavior of large-scale distribut...Yuri Victorovich2019-05-171-0/+1 * New port: science/nest: Simulator for spiking neural network modelsYuri Victorovich2019-05-121-0/+1 * New port: science/apbs: Electrostatic and solvation properties for complex mo...Yuri Victorovich2019-05-031-0/+1 * New port: science/pagmo2: Platform to perform parallel computations of optimi...Yuri Victorovich2019-05-011-0/+1 * New port: science/cp2k-data: Data for cp2k quantum chemistry packageYuri Victorovich2019-04-071-0/+1 * New port: science/py-qcengine: Quantum chemistry program executor and IO stan...Yuri Victorovich2019-03-311-0/+1 * New port: science/py-qcelemental: Essentials for quantum chemistryYuri Victorovich2019-03-311-0/+1 * Re-add science/py-veusz: the latest version builds with Qt5Yuri Victorovich2019-03-181-0/+1 * Add py-geometer 0.1.2Sunpoet Po-Chuan Hsieh2019-03-181-0/+1 * Qt4 deprecation: Remove Qt4 and its consumes.Tobias C. Berner2019-03-171-5/+0 * Remove expired ports:Rene Ladan2019-03-071-2/+0 * New port: science/dvc: Git for data scientists: manage code and data togetherYuri Victorovich2019-02-191-0/+1 * Move: science/mmtf -> science/mmtf-cppYuri Victorovich2019-02-161-1/+1 * New port: science/opsin: Open Parser for Systematic IUPAC Nomenclature of che...Yuri Victorovich2019-02-141-0/+1 * Re-add: science/jmol: Java 3D viewer for chemical structuresYuri Victorovich2019-02-131-0/+1 * New port: science/molscript: Display 3D molecules in schematic and detailed r...Yuri Victorovich2019-02-131-0/+1 * New port: science/py-oddt: Open Drug Discovery ToolkitYuri Victorovich2019-02-101-0/+1 * New port: science/healpix: Software for pixelization, visualization, etc of d...Yuri Victorovich2019-01-281-0/+1 * New port: science/nwchem-data: Data for NWChem, the computational chemistry s...Yuri Victorovich2019-01-271-0/+1 * Sort categories Makefiles.Mathieu Arnold2019-01-231-3/+3 * New port: science/py-rmsd: Calculate root-mean-square deviation (RMSD) betwee...Yuri Victorovich2019-01-181-0/+1 * Add py-asdf 2.3.1Sunpoet Po-Chuan Hsieh2019-01-181-0/+1 * New port: science/erkale-pseudopotentials: Pseudopotentials for Erkale, the q...Yuri Victorovich2019-01-171-0/+1 * Remove KDE4, part 5Rene Ladan2019-01-011-2/+0 * Add new port science/scidavis:Max Brazhnikov2018-12-241-0/+1 * New port: science/vipster: Crystalline and molecular structure visualisation ...Yuri Victorovich2018-12-211-0/+1 * New port: science/agrum: Graphical modeler for Bayesian networks, influence d...Yuri Victorovich2018-12-201-0/+1 * New port: science/h5z-zfp: Registered ZFP compression plugin for HDF5Yuri Victorovich2018-12-191-0/+1 * New port: science/py-GPyOpt: Bayesian optimization toolbox based on GPyYuri Victorovich2018-12-181-0/+1 * New port: science/py-GPy: Gaussian process toolboxYuri Victorovich2018-12-181-0/+1 * New port: science/py-paramz: Parameterization frameworkYuri Victorovich2018-12-181-0/+1 * New port: science/drawxtl: Crystal structure visualization toolYuri Victorovich2018-12-171-0/+1 * Remove expired ports:Rene Ladan2018-12-111-1/+0 * Add py-pygeodesy 18.11.12Sunpoet Po-Chuan Hsieh2018-12-071-0/+1 * New port: science/yoda: Particle physics package with classes for data analys...Yuri Victorovich2018-11-271-0/+1 * New port: science/quantum-espresso-pseudopotentials: Pseudopotentials for use...Yuri Victorovich2018-11-221-0/+1 * New port: science/berkeleygw: Scientific program aimed at the ab initio virtu...Yuri Victorovich2018-11-201-0/+1 * New port: science/opensim-core: Software for modeling of musculoskeletal stru...Yuri Victorovich2018-11-161-0/+1 * New port: science/simbody: Multibody dynamics library for (bio)mechanical sys...Yuri Victorovich2018-11-151-0/+1 * Survival analysis in Python, including Kaplan Meier, Nelson Aalen and regressionRuslan Makhmatkhanov2018-11-141-0/+1 * New port: science/sparta: Gas simulator: SPARTA DSMC software packageYuri Victorovich2018-11-121-0/+1 * New port: science/esys-particle: Particle-based numerical modelling softwareYuri Victorovich2018-11-051-0/+1 * bft, ecs, fvm, mei and ncs have been merged to code_saturne.Thierry Thomas2018-11-051-5/+1 * New port: science/liggghts: Discrete element method particle simulation softwareYuri Victorovich2018-11-041-0/+1 * New port: science/latte: Quantum chemistry: Density functional tight binding ...Yuri Victorovich2018-11-011-0/+1 * New port: science/gpaw-setups: Setups (data files) for py-gpaw, the DFT quant...Yuri Victorovich2018-10-301-0/+1 * New port: science/coordgenlibs: Schrodinger-developed 2D coordinate generationYuri Victorovich2018-10-251-0/+1 * New port: science/maeparser: Parser for Schrodinger Maestro filesYuri Victorovich2018-10-251-0/+1 * New port: science/molsketch: 2D molecule editorYuri Victorovich2018-10-241-0/+1 * New port: science/erkale: Quantum chemistry program to solve the electronic s...Yuri Victorovich2018-10-221-0/+1 * New port: science/py-avogadrolibs: Python bindings for Avogadro2 chemistry li...Yuri Victorovich2018-10-221-0/+1 * New port: science/mmtf: C++ implementation of the MMTF API, decoder and encoderYuri Victorovich2018-10-191-0/+1 * New port: science/avogadro2: Chemical editor and visualization applicationYuri Victorovich2018-10-171-0/+1 * New port: science/avogadrolibs: Avogadro2 libraries for chemical editor and v...Yuri Victorovich2018-10-171-0/+1 * New port: science/libmsym: Molecular point group symmetry libraryYuri Victorovich2018-10-171-0/+1 * New port: science/wxmacmolplt: Graphical user interface principally for the G...Yuri Victorovich2018-10-151-0/+1 * Re-add port: science/gamess-us: General Atomic and Molecular Electronic Struc...Yuri Victorovich2018-10-141-0/+1 * New port: science/simint: Obara-Saika (OS) method of calculating electron rep...Yuri Victorovich2018-10-081-0/+1 * New port: science/molgif: Tool to create GIF animations of moleculesYuri Victorovich2018-10-081-0/+1 * biology/tinker: Update 7.1.3 -> 8.4.4; Move to science/Yuri Victorovich2018-10-071-0/+1 * New port: science/bagel: Brilliantly Advanced General Electronic-structure Li...Yuri Victorovich2018-09-261-0/+1 * New port: science/elk: All-electron full-potential linearised augmented-plane...Yuri Victorovich2018-09-231-0/+1 * New port: science/py-PyFR: Framework for solving advection-diffusion type pro...Yuri Victorovich2018-09-211-0/+1 * New port: science/py-chempy: Package useful useful for solving problems in ch...Yuri Victorovich2018-09-201-0/+1 * New port: science/luscus: Molecular editor and viewerYuri Victorovich2018-09-141-0/+1 * New port: science/py-phono3py: Software to calculate phonon-phonon interactio...Yuri Victorovich2018-09-141-0/+1 * New port: science/py-phonopy: Package for phonon calculations at harmonic and...Yuri Victorovich2018-09-141-0/+1 * New port: science/py-molmod: Collection of molecular modelling tools for pythonYuri Victorovich2018-09-141-0/+1 * New port: science/dftbplus: Package for performing fast atomistic simulationsYuri Victorovich2018-09-131-0/+1 * New port: science/openmx: Nanoscale material simulations using density functi...Yuri Victorovich2018-09-121-0/+1 * New port: science/msms: Program to efficiently compute molecular surfacesYuri Victorovich2018-09-10