 David Sehnal
|
a080114690
added Structure property to StructureElement and Bond locations
|
há 5 anos atrás |
|
Alexander Rose
|
48a75927f6
renamed 'link' to 'bond' as appropriate
|
há 5 anos atrás |
|
Alexander Rose
|
88d8998bd2
generalized InterUnitBonds to InterUnitGraph
|
há 5 anos atrás |
|
Alexander Rose
|
a476c2a167
rename Structure.links to .interUnitBonds
|
há 5 anos atrás |
|
David Sehnal
|
6707673c7f
mol-model: fixes to link related queries
|
há 5 anos atrás |
|
David Sehnal
|
8f78106816
mol-data: fix SortedArray.union & mol-model: fix includeConnected
|
há 5 anos atrás |
|
David Sehnal
|
6d39bc4a20
mol-script: added more link props, support different element reference for atomic props
|
há 5 anos atrás |
|
Alexander Rose
|
f975d9c8dc
add names anon molql functions for debugging/profiling
|
há 5 anos atrás |
|
Alexander Rose
|
f2f1e355c2
molql, fix expandConnected
|
há 5 anos atrás |
|
David Sehnal
|
ea46b1c8c8
mol-script: bond* => link*; make link tests "covalent" by default; wip link tests
|
há 5 anos atrás |
|
David Sehnal
|
d84d5f38f5
mol-model: implemented includeConnected query
|
há 5 anos atrás |
|
Alexander Rose
|
560da38687
fixed exceptBy and structureSubtract
|
há 5 anos atrás |
|
Alexander Rose
|
2c55165c84
use relative paths for module imports
|
há 5 anos atrás |
|
David Sehnal
|
118daa2b25
StructureElement.Loci.toScriptExpression, mol-script fixes
|
há 6 anos atrás |
|
David Sehnal
|
da051fd1f8
Fix build & tests
|
há 6 anos atrás |
|
David Sehnal
|
4fde56181e
wip includeConnected
|
há 6 anos atrás |
|
David Sehnal
|
aff2cdc30d
mol-model/query include surroundings radius support
|
há 6 anos atrás |
|
David Sehnal
|
486e860575
mol-model/query expandProperty, some "query modifer" tweaks
|
há 6 anos atrás |
|
David Sehnal
|
4ec57eb89b
mol-model/query intersectBy, exceptBy, union
|
há 6 anos atrás |
|
David Sehnal
|
394813233b
mol-model/query querySelection
|
há 6 anos atrás |
|
David Sehnal
|
e583efef28
wip, mol-model query
|
há 6 anos atrás |
|
David Sehnal
|
923b91bfb7
mol-model/query timeout
|
há 6 anos atrás |
|
David Sehnal
|
599ab54063
queries are now synchronous due to performance reasons
|
há 6 anos atrás |
|
David Sehnal
|
6afe808555
wip mol-model/query
|
há 6 anos atrás |
