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Merge pull request #2262 from steps-re/fix/dynamics-hinges-collectivity
CI
#2266:
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08e4e0a
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karolamik13
8m 10s
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Merge pull request #2282 from briza81/cavitracer_multimodel
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#2265:
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Cavitracer multimodel
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#2264:
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4m 19s
briza81:cavitracer_multimodel
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Cavitracer multimodel
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#2263:
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9m 25s
briza81:cavitracer_multimodel
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Add calcSignatureCavities/calcSignatureChannels for ensemble signatur…
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#2262:
Pull request
#2268
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stoneandbone
8m 46s
stoneandbone:feature/signature-cavity-channel-ensemble
stoneandbone:feature/signature-cavity-channel-ensemble
8m 46s
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Cavitracer multimodel
CI
#2261:
Pull request
#2282
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briza81
9m 24s
briza81:cavitracer_multimodel
briza81:cavitracer_multimodel
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Merge pull request #2280 from karolamik13/prody__main
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#2260:
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b5da318
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Parse hybrid-36 all-digit residue fields as decimal
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#2259:
Pull request
#2281
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shaneraphel
Action required
shaneraphel:parsepdb-hybrid36-decimal
shaneraphel:parsepdb-hybrid36-decimal
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CaviTracer - visualization for PyMol and ChimeraX
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#2258:
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#2280
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karolamik13
8m 26s
karolamik13:prody__main
karolamik13:prody__main
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Merge pull request #2279 from karolamik13/prody__main
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8m 41s
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VMD visualization of CaviTracer
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#2256:
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9m 12s
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karolamik13:prody__main
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VMD visualization of CaviTracer
CI
#2255:
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9m 55s
karolamik13:prody__main
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Merge pull request #2275 from jamesmkrieger/jamesk-claude/psf-topolog…
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Merge pull request #2276 from jamesmkrieger/jamesk-claude/pdb-cryst1-…
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Merge pull request #2278 from briza81/CaviTracer-extra-options
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#2252:
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5ffabac
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9m 12s
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9m 12s
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CaviTracer: mmCIF output, a truer lining measurement, and multi-frame fixes
CI
#2251:
Pull request
#2278
opened by
briza81
10m 42s
briza81:CaviTracer-extra-options
briza81:CaviTracer-extra-options
10m 42s
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spawn-safe and order-safe parallel insty and watfinder fixes
CI
#2250:
Pull request
#2277
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10m 2s
jamesmkrieger:jamesk-claude/spawn-safe-parallel
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spawn-safe and order-safe parallel insty and watfinder fixes
CI
#2249:
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18m 26s
jamesmkrieger:jamesk-claude/spawn-safe-parallel
jamesmkrieger:jamesk-claude/spawn-safe-parallel
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spawn-safe and order-safe parallel insty and watfinder fixes
CI
#2248:
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jamesmkrieger
11m 33s
jamesmkrieger:jamesk-claude/spawn-safe-parallel
jamesmkrieger:jamesk-claude/spawn-safe-parallel
11m 33s
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spawn-safe and order-safe parallel insty and watfinder fixes
CI
#2247:
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jamesmkrieger
13m 34s
jamesmkrieger:jamesk-claude/spawn-safe-parallel
jamesmkrieger:jamesk-claude/spawn-safe-parallel
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View #2277
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spawn-safe and order-safe parallel insty and watfinder fixes
CI
#2246:
Pull request
#2277
opened by
jamesmkrieger
10m 18s
jamesmkrieger:jamesk-claude/spawn-safe-parallel
jamesmkrieger:jamesk-claude/spawn-safe-parallel
10m 18s
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writePDB(box=...) for CRYST1 and parsePDB(hexadecimal=True) override
CI
#2245:
Pull request
#2276
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12m 57s
jamesmkrieger:jamesk-claude/pdb-cryst1-and-hex
jamesmkrieger:jamesk-claude/pdb-cryst1-and-hex
12m 57s
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Fix CHARMM PSF topology handling: cross-term width, term order, and topology under selection
CI
#2244:
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7m 57s
jamesmkrieger:jamesk-claude/psf-topology-order
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writePDB(box=...) for CRYST1 and parsePDB(hexadecimal=True) override
CI
#2243:
Pull request
#2276
opened by
jamesmkrieger
8m 6s
jamesmkrieger:jamesk-claude/pdb-cryst1-and-hex
jamesmkrieger:jamesk-claude/pdb-cryst1-and-hex
8m 6s
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Fix CHARMM PSF topology handling: cross-term width, term order, and topology under selection
CI
#2242:
Pull request
#2275
opened by
jamesmkrieger
8m 39s
jamesmkrieger:jamesk-claude/psf-topology-order
jamesmkrieger:jamesk-claude/psf-topology-order
8m 39s
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