 Alexander Rose
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ba50760f92
add key to symmetry operator
|
il y a 2 ans |
|
Alexander Rose
|
c10a21ecbd
add key property to intra- and inter-bonds
|
il y a 2 ans |
|
Alexander Rose
|
0c0e995256
lint: add no-multi-spaces rule
|
il y a 3 ans |
|
dsehnal
|
73f6793bd8
surroundingLigands query wip
|
il y a 4 ans |
|
dsehnal
|
82dd0496c2
covalentlyBondedComponent query
|
il y a 4 ans |
|
Alexander Rose
|
6c5224f33e
new linting rules
|
il y a 4 ans |
|
Alexander Rose
|
2142290300
add prd_id as entity property, treat prd as ligand
|
il y a 5 ans |
|
Alexander Rose
|
0b1c18913d
added MolScript.core.list.equal and MolScript.structureQuery.atomProperty.macromolecular.entityDescription
|
il y a 5 ans |
|
David Sehnal
|
fb0634a0f4
added semicolons to linting rules
|
il y a 5 ans |
|
Alexander Rose
|
b863aaedb3
general support for aromatic rings
|
il y a 5 ans |
|
Alexander Rose
|
48a75927f6
renamed 'link' to 'bond' as appropriate
|
il y a 5 ans |
|
David Sehnal
|
6707673c7f
mol-model: fixes to link related queries
|
il y a 5 ans |
|
David Sehnal
|
14c22147d5
mol-script: added linkedAtomicPairs generator + fixed assembly-symmetry-axes isApplicable for empty structures
|
il y a 5 ans |
|
David Sehnal
|
6d39bc4a20
mol-script: added more link props, support different element reference for atomic props
|
il y a 5 ans |
|
Alexander Rose
|
4cc0754f11
add isNonStandard atom prop, use polymer repr preset
|
il y a 5 ans |
|
Alexander Rose
|
1ed420aeb7
added entity.subtype based on _entity_poly.type and _pdbx_entity_branch.type
|
il y a 5 ans |
|
David Sehnal
|
ea46b1c8c8
mol-script: bond* => link*; make link tests "covalent" by default; wip link tests
|
il y a 5 ans |
|
Alexander Rose
|
82e667e402
added chemCompType and other mol-script improvements
|
il y a 5 ans |
|
Alexander Rose
|
c28feb2d1c
added `objectPrimitive` to unit and mol-script
|
il y a 5 ans |
|
David Sehnal
|
bc91f0d3ff
Support multiple models in StructureElement.Loci.toScriptExpression
|
il y a 5 ans |
|
Alexander Rose
|
dd81d1ad2b
updated carb entity type
|
il y a 6 ans |
|
David Sehnal
|
2632f9db4d
proteopedia wrapper
|
il y a 6 ans |
|
David Sehnal
|
4e9333b5c0
mol-model: make StructureElement.Loci.toScriptExpression work on assemblies
|
il y a 6 ans |
|
David Sehnal
|
118daa2b25
StructureElement.Loci.toScriptExpression, mol-script fixes
|
il y a 6 ans |
|
David Sehnal
|
a5286338bf
added sourceIndex property to mol-script
|
il y a 6 ans |
|
David Sehnal
|
70552be5cd
wip, mol-script
|
il y a 6 ans |
