Ecosyste.ms: Issues

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

GitHub / chemfiles/chemfiles issues and pull requests

#422 - Add a test & fix for opening the same file from multiple threads

Pull Request - State: closed - Opened by Luthaf about 3 years ago - 5 comments

#422 - Add a test & fix for opening the same file from multiple threads

Pull Request - State: closed - Opened by Luthaf about 3 years ago - 5 comments

#420 - Update Molfile.cpp

Pull Request - State: closed - Opened by shoubhikraj about 3 years ago

#420 - Update Molfile.cpp

Pull Request - State: closed - Opened by shoubhikraj about 3 years ago

#419 - Handling of unit cell parameters when they are missing from the file

Issue - State: open - Opened by shoubhikraj about 3 years ago - 7 comments
Labels: A-formats, A-documentation

#419 - Handling of unit cell parameters when they are missing from the file

Issue - State: open - Opened by shoubhikraj about 3 years ago - 7 comments
Labels: A-formats, A-documentation

#418 - Is chemfiles thread-safe (e.g. with OpenMP)?

Issue - State: closed - Opened by shoubhikraj about 3 years ago - 12 comments
Labels: A-documentation

#418 - Is chemfiles thread-safe (e.g. with OpenMP)?

Issue - State: closed - Opened by shoubhikraj about 3 years ago - 12 comments
Labels: A-documentation

#416 - Set SOVERSION to the subset of the version that matter for compatibility

Issue - State: closed - Opened by Luthaf about 3 years ago
Labels: bug

#416 - Set SOVERSION to the subset of the version that matter for compatibility

Issue - State: closed - Opened by Luthaf about 3 years ago
Labels: bug

#415 - Tracking issue for release 0.10.1

Issue - State: closed - Opened by Luthaf about 3 years ago
Labels: Help wanted

#415 - Tracking issue for release 0.10.1

Issue - State: closed - Opened by Luthaf about 3 years ago
Labels: Help wanted

#414 - Backports for 0.10.1

Pull Request - State: closed - Opened by Luthaf about 3 years ago

#414 - Backports for 0.10.1

Pull Request - State: closed - Opened by Luthaf about 3 years ago

#413 - Read Arbitrary Per-Atom Properties in LAMMPS Atoms Format

Pull Request - State: closed - Opened by ezavod about 3 years ago
Labels: A-formats

#412 - Better eof handling

Pull Request - State: closed - Opened by Luthaf about 3 years ago - 3 comments
Labels: A-formats

#412 - Better eof handling

Pull Request - State: closed - Opened by Luthaf about 3 years ago - 3 comments
Labels: A-formats

#411 - Backport #407 #410

Pull Request - State: closed - Opened by Luthaf about 3 years ago

#411 - Backport #407 #410

Pull Request - State: closed - Opened by Luthaf about 3 years ago

#410 - Small updates to documentation

Pull Request - State: closed - Opened by Luthaf about 3 years ago

#410 - Small updates to documentation

Pull Request - State: closed - Opened by Luthaf about 3 years ago

#409 - Lammps dump properties not found.

Issue - State: closed - Opened by SamTov about 3 years ago - 24 comments

#409 - Lammps dump properties not found.

Issue - State: closed - Opened by SamTov about 3 years ago - 24 comments

#408 - Use github Actions for CI in the 0.10 branch

Pull Request - State: closed - Opened by Luthaf about 3 years ago

#407 - CIF/mmCIF improvements

Pull Request - State: closed - Opened by Luthaf about 3 years ago - 2 comments

#407 - CIF/mmCIF improvements

Pull Request - State: closed - Opened by Luthaf about 3 years ago - 2 comments

#406 - Backports to release-0.10

Pull Request - State: closed - Opened by Luthaf about 3 years ago - 3 comments

#406 - Backports to release-0.10

Pull Request - State: closed - Opened by Luthaf about 3 years ago - 3 comments

#405 - Add a guess_format function returning the format we would use for a given filename

Pull Request - State: closed - Opened by Luthaf over 3 years ago - 1 comment
Labels: A-formats, A-API

#405 - Add a guess_format function returning the format we would use for a given filename

Pull Request - State: closed - Opened by Luthaf over 3 years ago - 1 comment
Labels: A-formats, A-API

#404 - Error: issue not found

Issue - State: closed - Opened by Luthaf over 3 years ago

#404 - Error: issue not found

Issue - State: closed - Opened by Luthaf over 3 years ago

#403 - Guarantee fixed iteration order over properties

Pull Request - State: closed - Opened by Luthaf over 3 years ago

#403 - Guarantee fixed iteration order over properties

Pull Request - State: closed - Opened by Luthaf over 3 years ago

#402 - Update dependencies to latest released versions

Pull Request - State: closed - Opened by Luthaf over 3 years ago

#402 - Update dependencies to latest released versions

Pull Request - State: closed - Opened by Luthaf over 3 years ago

#401 - Remove configuration file

Pull Request - State: closed - Opened by Luthaf over 3 years ago - 1 comment

#401 - Remove configuration file

Pull Request - State: closed - Opened by Luthaf over 3 years ago - 1 comment

#400 - Remove configuration files

Issue - State: closed - Opened by Luthaf over 3 years ago
Labels: A-API

#399 - Backport #391 to release 0.10

Pull Request - State: closed - Opened by Luthaf over 3 years ago

#398 - `Trajectory::read` fails after an exception

Issue - State: closed - Opened by Luthaf over 3 years ago - 1 comment
Labels: bug, A-formats

#398 - `Trajectory::read` fails after an exception

Issue - State: closed - Opened by Luthaf over 3 years ago - 1 comment
Labels: bug, A-formats

#397 - Document internal units used in chemfiles; and guarantees around these units for each format

Issue - State: open - Opened by Luthaf over 3 years ago
Labels: A-documentation

#397 - Document internal units used in chemfiles; and guarantees around these units for each format

Issue - State: open - Opened by Luthaf over 3 years ago
Labels: A-documentation

#396 - Backports #390 and #395 to release-0.10

Pull Request - State: closed - Opened by Luthaf over 3 years ago

#396 - Backports #390 and #395 to release-0.10

Pull Request - State: closed - Opened by Luthaf over 3 years ago

#395 - Fix switched doc for XXX_INSTALL_DIR

Pull Request - State: closed - Opened by Luthaf over 3 years ago

#395 - Fix switched doc for XXX_INSTALL_DIR

Pull Request - State: closed - Opened by Luthaf over 3 years ago

#394 - Switch from Travis to github actions

Pull Request - State: closed - Opened by Luthaf over 3 years ago - 1 comment

#393 - Switch from Travis to github actions

Pull Request - State: closed - Opened by Luthaf over 3 years ago - 1 comment

#393 - Switch from Travis to github actions

Pull Request - State: closed - Opened by Luthaf over 3 years ago - 1 comment

#392 - Wrong detection of file ends in text files

Issue - State: closed - Opened by ezavod over 3 years ago - 3 comments
Labels: bug, A-internals

#391 - feat: rewrite LAMMPS trajectory reader

Pull Request - State: closed - Opened by ezavod over 3 years ago - 7 comments

#391 - feat: rewrite LAMMPS trajectory reader

Pull Request - State: closed - Opened by ezavod over 3 years ago - 7 comments

#390 - Update emscripten configuration for Emscripten 2

Pull Request - State: closed - Opened by Luthaf over 3 years ago

#390 - Update emscripten configuration for Emscripten 2

Pull Request - State: closed - Opened by Luthaf over 3 years ago

#389 - New DCD importer/exporter

Pull Request - State: closed - Opened by ynaimi over 3 years ago - 3 comments

#389 - New DCD importer/exporter

Pull Request - State: closed - Opened by ynaimi over 3 years ago - 3 comments

#388 - Update cmake compatibility bounds

Issue - State: closed - Opened by Luthaf over 3 years ago - 2 comments
Labels: A-internals

#388 - Update cmake compatibility bounds

Issue - State: closed - Opened by Luthaf over 3 years ago - 2 comments
Labels: A-internals

#371 - Rewrite LAMMPS trajectory reader

Issue - State: closed - Opened by Luthaf about 4 years ago - 1 comment
Labels: A-formats

#371 - Rewrite LAMMPS trajectory reader

Issue - State: closed - Opened by Luthaf about 4 years ago - 1 comment
Labels: A-formats

#370 - Rewrite DCD reader from VMD molfile to our own implementation

Issue - State: closed - Opened by lmiq about 4 years ago - 13 comments
Labels: A-formats

#370 - Rewrite DCD reader from VMD molfile to our own implementation

Issue - State: closed - Opened by lmiq about 4 years ago - 13 comments
Labels: A-formats

#353 - Implement Amber Restart Format

Pull Request - State: closed - Opened by ezavod about 4 years ago - 2 comments
Labels: A-formats

#353 - Implement Amber Restart Format

Pull Request - State: closed - Opened by ezavod about 4 years ago - 2 comments
Labels: A-formats

#311 - Test on more architectures on CI

Issue - State: open - Opened by Luthaf over 4 years ago - 1 comment

#282 - Update travis to use ubuntu 16.04

Issue - State: closed - Opened by Luthaf almost 5 years ago

#282 - Update travis to use ubuntu 16.04

Issue - State: closed - Opened by Luthaf almost 5 years ago

#280 - Extend formats documentations

Issue - State: closed - Opened by Luthaf almost 5 years ago - 2 comments
Labels: A-documentation

#280 - Extend formats documentations

Issue - State: closed - Opened by Luthaf almost 5 years ago - 2 comments
Labels: A-documentation

#237 - CBX file format support

Issue - State: open - Opened by frodofine over 5 years ago
Labels: A-formats

#237 - CBX file format support

Issue - State: open - Opened by frodofine over 5 years ago
Labels: A-formats

#208 - Implement PSF file format

Issue - State: open - Opened by Luthaf almost 6 years ago - 10 comments
Labels: A-formats

#208 - Implement PSF file format

Issue - State: open - Opened by Luthaf almost 6 years ago - 10 comments
Labels: A-formats

#188 - Discussion on InChI Support

Issue - State: open - Opened by frodofine about 6 years ago - 12 comments
Labels: A-formats, A-API, A-internals

#154 - Rewrite molfile plugins

Issue - State: closed - Opened by Luthaf over 6 years ago - 7 comments
Labels: A-formats

#154 - Rewrite molfile plugins

Issue - State: closed - Opened by Luthaf over 6 years ago - 7 comments
Labels: A-formats

#47 - Support restart convention for NetCDF

Issue - State: closed - Opened by Luthaf almost 8 years ago
Labels: A-formats

#47 - Support restart convention for NetCDF

Issue - State: closed - Opened by Luthaf almost 8 years ago
Labels: A-formats

#38 - Heuristic to guess residues in a topology

Issue - State: closed - Opened by Luthaf about 8 years ago - 1 comment
Labels: A-internals

#38 - Heuristic to guess residues in a topology

Issue - State: closed - Opened by Luthaf about 8 years ago - 1 comment
Labels: A-internals