Commits

History for

Commits on Jun 18, 2018

Revert fix for mmcif files without auth_seq_id column
sbliven
committed
08ab3e1

Commits on Jun 15, 2018

Fix test failure due to PDB change
sbliven
committed
0c10a2e

Commits on Jun 14, 2018

Fix NullPointer when restoring global state
sbliven
committed
c1c3c30
Add GlobalsHelper class to manage our global state
sbliven
committed
13f267c

Commits on Jun 12, 2018

Incorporating suggestions from @josemduarte
sbliven
committed
f5b325f

Commits on Jun 8, 2018

Set and restore the ChemCompGroupFactory singleton
sbliven
committed
62fb2a4
Make tests for #703 fail with an assertion
sbliven
committed
b207d34

Commits on Jun 4, 2018

Add test for #703
sbliven
committed
4785d57

Commits on Dec 8, 2017

Back porting fix and test for #716
josemduarte
committed
8f5d03d
Fix and unit test for #715
josemduarte
committed
fe8c716

Commits on Oct 19, 2017

Merge pull request #707 from edlunde-dnastar/linelength424
josemduarte
authored
58b00ff
Fixing another test problem related to v5
josemduarte
committed
5d753fd
Fixing test issues related to v5 and changes in rcsb
josemduarte
committed
b840f05

Commits on Oct 18, 2017

Fixing tests after PDB v5 remediation
josemduarte
committed
017df86
Changes for CONECT/LINK
larsonmattr
committed
e88637c

Commits on Jul 13, 2017

Fixing test after case change in RCSB rest service
josemduarte
committed
a24e23e

Commits on Jul 5, 2017

Fixing test after remediation
josemduarte
committed
42d628d
Updating to latest RCSB URL
josemduarte
committed
541b61c

Commits on Nov 30, 2016

Added exception handler for out-of-bounds errors when parsing lines, usually indicative of misformated lines.
Matt Larson
committed
50c34d3

Commits on Nov 23, 2016

Fixed bug: NPE for CrystalBuilder on 4hhb. Moved TestCrystalBuilder to integrationtest.
josemduarte
committed
a2f900c

Commits on Nov 22, 2016

Commits on Jul 13, 2016

Fixing #533
josemduarte
committed
2785fdf

Commits on Jun 22, 2016

Introduce @CIFLabel(label="str") annotation

sbliven
authored and
josemduarte
committed
e70dcbb
Fix #480. Correct spelling of _symmetry.space_group_name_H-M in CIF output

sbliven
authored and
josemduarte
committed
19931b5

Commits on Jun 13, 2016

Adapt CeSymm code to new SymmetryAxes API
lafita
committed
5591b2d

Commits on Jun 7, 2016

Fix symmetry axes position bug
sbliven
committed
58f108c
Add information for construction of full list of symmetry axes.
sbliven
committed
eef9765

Commits on Jun 6, 2016

Refactor SymmetryAxis class to encapsulate individual axes
sbliven
committed
87586f6

Commits on Jun 3, 2016

Simplify SymmetryAxis implementation & fix getSymmetryAxes()
sbliven
committed
3f3a2c5
Adding TestSymmetryAxes prior to refactoring
sbliven
committed
3d47cf2

Commits on Apr 29, 2016

Added handling of '?' and other non integer string for the charge.

abradle
authored and
josemduarte
committed
f24019f
Refactored ChargeAdder and fixed bugs where it wasn't adding charges to all groups.

abradle
authored and
josemduarte
committed
22ab7d4

Commits on Apr 11, 2016

Fixing bug in mmcif writing: ins codes were written as ascii code
josemduarte
committed
a191165

Commits on Apr 6, 2016

Fix #449 by copying SEQRES to new chains
sbliven
committed
bfb6a31