Ecosyste.ms: Issues

An open API service for providing issue and pull request metadata for open source projects.

GitHub / pyiron/pylammpsmpi issues and pull requests

#192 - Fix coverage

Pull Request - State: closed - Opened by jan-janssen 10 months ago

#191 - Update pympipool to 0.8.0

Pull Request - State: closed - Opened by jan-janssen 10 months ago

#190 - Bump pympipool from 0.7.17 to 0.7.18

Pull Request - State: closed - Opened by dependabot[bot] 10 months ago - 1 comment
Labels: dependencies

#189 - Set upper limit for Python version

Pull Request - State: closed - Opened by jan-janssen 10 months ago

#188 - Bump mpi4py from 3.1.5 to 3.1.6

Pull Request - State: closed - Opened by dependabot[bot] 10 months ago
Labels: dependencies

#187 - Use Python 3.12 as default for Continuous Integration

Pull Request - State: closed - Opened by jan-janssen 10 months ago

#186 - Merge main

Pull Request - State: closed - Opened by jan-janssen 10 months ago

#185 - Update also the environment in binder/environment.yml

Pull Request - State: closed - Opened by jan-janssen 10 months ago

#184 - Update LAMMPS to 2024.02.07

Pull Request - State: closed - Opened by jan-janssen 10 months ago

#183 - Bump scipy from 1.12.0 to 1.13.0

Pull Request - State: closed - Opened by dependabot[bot] 10 months ago - 2 comments
Labels: dependencies

#182 - Update pympipool to 0.7.17

Pull Request - State: closed - Opened by jan-janssen 11 months ago

#181 - Call python executable via sys.executable

Pull Request - State: closed - Opened by jan-janssen 12 months ago

#180 - Bump pympipool from 0.7.14 to 0.7.15

Pull Request - State: closed - Opened by dependabot[bot] 12 months ago
Labels: dependencies

#179 - Bump pympipool from 0.7.13 to 0.7.14

Pull Request - State: closed - Opened by dependabot[bot] 12 months ago
Labels: dependencies

#178 - Fix coverage

Pull Request - State: closed - Opened by jan-janssen 12 months ago

#177 - Add sleep interval parameter

Pull Request - State: closed - Opened by jan-janssen 12 months ago
Labels: format_black

#176 - LammpsLibrary hangs on close

Issue - State: open - Opened by pmrv 12 months ago - 12 comments
Labels: bug

#175 - Bump pympipool from 0.7.11 to 0.7.13

Pull Request - State: closed - Opened by dependabot[bot] 12 months ago - 1 comment
Labels: dependencies

#174 - Switch dependabot to daily

Pull Request - State: closed - Opened by jan-janssen 12 months ago

#173 - Bump numpy from 1.26.3 to 1.26.4

Pull Request - State: closed - Opened by dependabot[bot] 12 months ago - 1 comment
Labels: dependencies

#172 - Update LAMMPS to 2023.11.21

Pull Request - State: closed - Opened by jan-janssen about 1 year ago

#171 - update pympipool to 0.7.11

Pull Request - State: closed - Opened by jan-janssen about 1 year ago

#170 - Bump scipy from 1.11.4 to 1.12.0

Pull Request - State: closed - Opened by dependabot[bot] about 1 year ago
Labels: dependencies

#169 - Delete .github/delete-merged-branch-config.yml

Pull Request - State: closed - Opened by jan-janssen about 1 year ago

#168 - Add more tests for base

Pull Request - State: closed - Opened by jan-janssen about 1 year ago

#167 - Update numpy to 1.26.3

Pull Request - State: closed - Opened by jan-janssen about 1 year ago

#166 - Implement interactive_velocities_getter()

Pull Request - State: closed - Opened by jan-janssen about 1 year ago

#165 - RaisingThread not found

Issue - State: closed - Opened by samwaseda about 1 year ago - 7 comments

#164 - Update pympipool to 0.7.9

Pull Request - State: closed - Opened by jan-janssen about 1 year ago

#163 - Update readthedocs environment

Pull Request - State: closed - Opened by jan-janssen about 1 year ago

#162 - Test pip no-build-isolation option

Pull Request - State: closed - Opened by jan-janssen about 1 year ago

#161 - Switch to pyproject.toml

Pull Request - State: closed - Opened by jan-janssen about 1 year ago

#160 - Update black action

Pull Request - State: closed - Opened by jan-janssen about 1 year ago

#159 - Test lower limits of dependencies

Pull Request - State: closed - Opened by jan-janssen about 1 year ago

#158 - Bump scipy from 1.11.3 to 1.11.4

Pull Request - State: closed - Opened by dependabot[bot] about 1 year ago - 1 comment
Labels: dependencies

#157 - Update pympipool to 0.7.5

Pull Request - State: closed - Opened by jan-janssen about 1 year ago

#156 - Use trusted publisher action

Pull Request - State: closed - Opened by jan-janssen about 1 year ago

#155 - Bump numpy from 1.26.0 to 1.26.2

Pull Request - State: closed - Opened by dependabot[bot] about 1 year ago - 1 comment
Labels: dependencies

#154 - Bump pympipool from 0.7.2 to 0.7.3

Pull Request - State: closed - Opened by dependabot[bot] about 1 year ago
Labels: dependencies

#153 - Bump pympipool from 0.7.1 to 0.7.2

Pull Request - State: closed - Opened by dependabot[bot] over 1 year ago
Labels: dependencies

#152 - Update pympipool to 0.7.2

Pull Request - State: closed - Opened by jan-janssen over 1 year ago - 1 comment

#151 - Bump numpy from 1.26.0 to 1.26.1

Pull Request - State: closed - Opened by dependabot[bot] over 1 year ago - 1 comment
Labels: dependencies

#150 - Bump mpi4py from 3.1.4 to 3.1.5

Pull Request - State: closed - Opened by dependabot[bot] over 1 year ago - 2 comments
Labels: dependencies

#149 - Migration to Python 3.12

Pull Request - State: closed - Opened by jan-janssen over 1 year ago - 1 comment

#148 - Update Lammps to 2023.08.02

Pull Request - State: closed - Opened by jan-janssen over 1 year ago

#147 - Use Coveralls Github action

Pull Request - State: closed - Opened by jan-janssen over 1 year ago - 2 comments

#146 - Update pympipool to 0.7.1

Pull Request - State: closed - Opened by jan-janssen over 1 year ago

#145 - versioneer update to 0.29

Pull Request - State: closed - Opened by jan-janssen over 1 year ago

#144 - Bump scipy from 1.11.2 to 1.11.3

Pull Request - State: closed - Opened by dependabot[bot] over 1 year ago
Labels: dependencies

#143 - Environment issues

Issue - State: closed - Opened by srmnitc over 1 year ago - 3 comments

#142 - New version 0.2.3 is not installed

Issue - State: closed - Opened by srmnitc over 1 year ago - 2 comments

#141 - Bump numpy from 1.23.5 to 1.26.0

Pull Request - State: closed - Opened by dependabot[bot] over 1 year ago - 1 comment
Labels: dependencies

#139 - Bump scipy from 1.11.1 to 1.11.2

Pull Request - State: closed - Opened by dependabot[bot] over 1 year ago
Labels: dependencies

#138 - Compatibility to the latest changes in pympipool

Pull Request - State: closed - Opened by jan-janssen over 1 year ago

#137 - Bump numpy from 1.23.5 to 1.25.2

Pull Request - State: closed - Opened by dependabot[bot] over 1 year ago - 1 comment
Labels: dependencies

#136 - Bump pympipool from 0.6.1 to 0.6.2

Pull Request - State: closed - Opened by dependabot[bot] over 1 year ago
Labels: dependencies

#135 - Numpy 1.24.3

Pull Request - State: closed - Opened by jan-janssen over 1 year ago - 1 comment

#134 - Bump pympipool from 0.6.0 to 0.6.1

Pull Request - State: closed - Opened by dependabot[bot] over 1 year ago
Labels: dependencies

#133 - Bump scipy from 1.10.1 to 1.11.1

Pull Request - State: closed - Opened by dependabot[bot] over 1 year ago
Labels: dependencies

#132 - Add CI timeout

Pull Request - State: closed - Opened by jan-janssen over 1 year ago

#131 - Use new pympipool interface

Pull Request - State: closed - Opened by jan-janssen over 1 year ago

#130 - Add SLURM backend

Pull Request - State: closed - Opened by jan-janssen over 1 year ago
Labels: format_black

#129 - Move the ASE compatible interface from pyiron_lammps to pylammpsmpi

Pull Request - State: closed - Opened by jan-janssen over 1 year ago

#128 - Bump numpy from 1.23.5 to 1.25.1

Pull Request - State: closed - Opened by dependabot[bot] over 1 year ago - 2 comments
Labels: dependencies

#127 - Bump pympipool from 0.5.5 to 0.5.6

Pull Request - State: closed - Opened by dependabot[bot] over 1 year ago
Labels: dependencies

#126 - Remove the need to call start_process() manually

Pull Request - State: closed - Opened by jan-janssen over 1 year ago

#125 - [documentation] New documentation for version 0.2.0

Issue - State: open - Opened by jan-janssen over 1 year ago - 1 comment

#124 - Add Documentation

Pull Request - State: closed - Opened by jan-janssen over 1 year ago

#123 - Use RaisingThread from pympipool

Pull Request - State: closed - Opened by jan-janssen over 1 year ago

#122 - Bump pympipool from 0.5.2 to 0.5.4

Pull Request - State: closed - Opened by dependabot[bot] over 1 year ago
Labels: dependencies

#121 - Fix pympipool import

Pull Request - State: closed - Opened by jan-janssen over 1 year ago

#120 - Depend only on pympipool not on pyzmq

Pull Request - State: closed - Opened by jan-janssen over 1 year ago - 1 comment
Labels: format_black

#119 - flux implementation - support communication over the network

Pull Request - State: closed - Opened by jan-janssen over 1 year ago

#118 - Add flux backend support in lammps wrapper

Pull Request - State: closed - Opened by jan-janssen over 1 year ago

#117 - Move socket initialization to a separate function

Pull Request - State: closed - Opened by jan-janssen over 1 year ago
Labels: format_black

#116 - Flux support

Pull Request - State: closed - Opened by jan-janssen over 1 year ago
Labels: format_black

#115 - Implement Concurrent Lammps class

Pull Request - State: closed - Opened by jan-janssen over 1 year ago - 6 comments
Labels: format_black

#114 - Fix __del__

Pull Request - State: closed - Opened by jan-janssen over 1 year ago
Labels: format_black

#113 - Remove _send() and _receive()

Pull Request - State: closed - Opened by jan-janssen over 1 year ago

#112 - Implement __dir__() method

Pull Request - State: closed - Opened by jan-janssen over 1 year ago

#111 - [Feature] Create custom `concurrent.futures.Executor`

Issue - State: closed - Opened by jan-janssen over 1 year ago

#110 - Bump pympipool from 0.5.0 to 0.5.1

Pull Request - State: closed - Opened by dependabot[bot] over 1 year ago
Labels: dependencies

#109 - Test latest LAMMPS version

Pull Request - State: closed - Opened by jan-janssen over 1 year ago

#108 - update pympipool to 0.5.0

Pull Request - State: closed - Opened by jan-janssen over 1 year ago

#107 - Update UpdateDependabotPR.yml

Pull Request - State: closed - Opened by niklassiemer over 1 year ago

#106 - Use pympipool socket interface

Pull Request - State: closed - Opened by jan-janssen over 1 year ago - 2 comments

#105 - Make MPI functions accessible for external scripts

Pull Request - State: closed - Opened by jan-janssen over 1 year ago

#104 - Bump pyzmq from 25.0.2 to 25.1.0

Pull Request - State: closed - Opened by dependabot[bot] over 1 year ago - 2 comments
Labels: dependencies

#103 - Fix create_atoms()

Pull Request - State: closed - Opened by jan-janssen over 1 year ago - 5 comments
Labels: format_black

#102 - [Idea] Next generation interface

Issue - State: open - Opened by jan-janssen over 1 year ago - 1 comment

#101 - [Bug] create_atoms can be both a function or a command

Issue - State: closed - Opened by jan-janssen over 1 year ago - 1 comment

#100 - Bump pyzmq from 25.0.1 to 25.0.2

Pull Request - State: closed - Opened by dependabot[bot] almost 2 years ago
Labels: dependencies

#99 - Bump pyzmq from 25.0.0 to 25.0.1

Pull Request - State: closed - Opened by dependabot[bot] almost 2 years ago
Labels: dependencies

#98 - close connection

Pull Request - State: closed - Opened by jan-janssen almost 2 years ago

#97 - Communicated via zmq

Pull Request - State: closed - Opened by jan-janssen almost 2 years ago - 3 comments
Labels: format_black

#96 - Switch communication to zmq

Issue - State: closed - Opened by jan-janssen almost 2 years ago

#95 - extract_vairable()

Pull Request - State: closed - Opened by jan-janssen almost 2 years ago - 3 comments

#94 - Add tests for extract_compute()

Pull Request - State: closed - Opened by jan-janssen almost 2 years ago

#93 - for mpi_cores > 1 extract_variable does not return full array

Issue - State: closed - Opened by denisstrizhkin almost 2 years ago - 2 comments

#92 - Merge with master

Pull Request - State: closed - Opened by jan-janssen almost 2 years ago