Commits

Branch selector

 dcb9095

User selector

All users

Datepicker

All time

Commit History

Commits on Sep 15, 2022

• Rename wheel_cache_size to build_cache_size in asv.conf.json (MDAnalysis#3829)

  IAlibay

  authored
  dcb9095

  Copy full SHA for dcb9095

Commits on Sep 12, 2022

• Type hints for lib module (MDAnalysis#3729)

  Show description for e7ee5a4
  

  umak1106

  and

  jbarnoud

  authored
  e7ee5a4

  Copy full SHA for e7ee5a4

Commits on Sep 10, 2022

• Merge pull request MDAnalysis#3823 from umak1106/patch-5

  Show description for 0788165
  tylerjereddy

  authored
  0788165

  Copy full SHA for 0788165

• Annotations for init

  umak1106

  authored
  f8b359d

  Copy full SHA for f8b359d

Commits on Sep 8, 2022

• Fix ARM runner issues (MDAnalysis#3816)

  Show description for fc04038
  IAlibay

  authored
  fc04038

  Copy full SHA for fc04038

Commits on Sep 6, 2022

• Reduce warnings from Universe.empty (MDAnalysis#3814)

  jbarnoud

  authored
  93c0aac

  Copy full SHA for 93c0aac

Commits on Sep 5, 2022

• Avoid using set operations in distances.between (MDAnalysis#3807)

  Show description for 311b93e
  

  4 peopleauthored
  311b93e

  Copy full SHA for 311b93e

Commits on Sep 4, 2022

• Add a simple benchmark for bonds (MDAnalysis#3806)

  Show description for 4cdcd3f
  

  hmacdope

  and

  IAlibay

  authored
  4cdcd3f

  Copy full SHA for 4cdcd3f

• Remove AMBER entry in extra_requires (MDAnalysis#3810)

  Show description for 35ad3e8
  IAlibay

  authored
  35ad3e8

  Copy full SHA for 35ad3e8

Commits on Sep 1, 2022

• Update Chemfiles tests for 0.10.3 (MDAnalysis#3808)

  Show description for cb6e4f5
  

  Luthaf

  and

  IAlibay

  authored
  cb6e4f5

  Copy full SHA for cb6e4f5

Commits on Aug 31, 2022

• Fix citation in calc_distances.h (MDAnalysis#3805)

  hmacdope

  authored
  ba491be

  Copy full SHA for ba491be

Commits on Aug 30, 2022

• Start 2.4.0-dev0 (MDAnalysis#3809)

  IAlibay

  authored
  730ecf7

  Copy full SHA for 730ecf7

Commits on Aug 29, 2022

• Pre release 2.3.0 (MDAnalysis#3802)

  Show description for c56e8df
  IAlibay

  authored
  c56e8df

  Copy full SHA for c56e8df

• Update test_chemfiles.py (MDAnalysis#3799)

  IAlibay

  authored
  0c2a8f6

  Copy full SHA for 0c2a8f6

Commits on Aug 23, 2022

• Merge pull request MDAnalysis#3780 from tylerjereddy/treddy_native_m1_ci

  Show description for 578d28b
  tylerjereddy

  authored
  578d28b

  Copy full SHA for 578d28b

• Fix type annotations in lib.distances (MDAnalysis#3787)

  Show description for 97ec6df
  jbarnoud

  authored
  97ec6df

  Copy full SHA for 97ec6df

Commits on Aug 20, 2022

• CI: native M1 testing

  Show description for 4da39dc
  tylerjereddy

  committed
  4da39dc

  Copy full SHA for 4da39dc

Commits on Aug 5, 2022

• Edited overview.rst (MDAnalysis#3772)

  Show description for 6302b4c
  hsadia538

  authored
  6302b4c

  Copy full SHA for 6302b4c

Commits on Aug 3, 2022

• [CI] Update macos runners (MDAnalysis#3771)

  Show description for 7116d5e
  IAlibay

  authored
  7116d5e

  Copy full SHA for 7116d5e

• Merge pull request MDAnalysis#3751 from hmacdope/AtomGroupNSGrid

  richardjgowers

  authored
  cce5291

  Copy full SHA for cce5291

• Removed return of trajectory and universe in fixtures in test_distances.py (MDAnalysis#3769)

  Show description for b57b26e
  hsadia538

  authored
  b57b26e

  Copy full SHA for b57b26e

Commits on Jul 25, 2022

• Merge pull request MDAnalysis#3724 from yuxuanzhuang/opt_topology_serialization

  richardjgowers

  authored
  86efe83

  Copy full SHA for 86efe83

• Updated references format to BibTex. (MDAnalysis#3663)

  Show description for c3b03ea
  

  Estefania Barreto-Ojeda

  authored
  c3b03ea

  Copy full SHA for c3b03ea

• Merge branch 'develop' into opt_topology_serialization

  orbeckst

  authored
  b6c42c6

  Copy full SHA for b6c42c6

Commits on Jul 24, 2022

• Remove universal wheel creation from setup.cfg files (MDAnalysis#3763)

  IAlibay

  authored
  886cb60

  Copy full SHA for 886cb60

• Fix reading/writing CONECT records in PDB files with many atoms (MDAnalysis#3670)

  Show description for 9131388
  yuxuanzhuang

  authored
  9131388

  Copy full SHA for 9131388

Commits on Jul 23, 2022

• Add formalcharge attribute and read/write them from PDB (MDAnalysis#3755)

  Show description for d5c7cb9
  IAlibay

  authored
  d5c7cb9

  Copy full SHA for d5c7cb9

Commits on Jul 22, 2022

• Modernize tests under converters and visualization (MDAnalysis#3757)

  Show description for 50b8fdb
  rzhao271

  authored
  50b8fdb

  Copy full SHA for 50b8fdb

• Merge remote-tracking branch 'upstream/develop' into AtomGroupNSGrid

  hmacdope

  committed
  65c6e02

  Copy full SHA for 65c6e02

• Allow distance routines to accept an NumPy Array or AtomGroup [Core] (MDAnalysis#3730)

  Show description for dbda8eb
  

  hmacdope

  and

  IAlibay

  authored
  dbda8eb

  Copy full SHA for dbda8eb

Commits on Jul 14, 2022

• pep8 again again

  hmacdope

  committed
  5483f6e

  Copy full SHA for 5483f6e

• pep8 again

  hmacdope

  committed
  2ade0b3

  Copy full SHA for 2ade0b3

• pep8

  hmacdope

  committed
  e435fd2

  Copy full SHA for e435fd2

• pep8

  hmacdope

  committed
  3440c2d

  Copy full SHA for 3440c2d

• improve tests

  hmacdope

  committed
  2236ccf

  Copy full SHA for 2236ccf

Pagination

Previous

Next