Commit History

feat: techspec additions β€” de novo tier-6 branch, structure export, page capture + final synthesis
4939f56

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feat(pipeline): multi-database UniProt identifier resolution
59ba48b

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fix(pipeline): stop abandoning slow NCBI BLAST jobs + EBI fallback
60c8e2d

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feat(results): in-app share dialog + self-normalized dotplot scoring
525a5b5

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feat(admet): ProTox 3.0 ML toxicity prediction β€” backend client + endpoint, frontend ProTox tab, restored sidebar chevron
38e4510

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feat(seq-tools): motif categories & structure overlay, dot-plot scoring & features, cross-tool links
033540e

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feat(seq-tools): add sequence utilities, motif scanner and dot plot tools with frontend pages
60aee05

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feat(primers): add NCBI gene search + sequence retrieval, oligo QC and in-silico PCR verification with recharts graphs
5d5e978

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feat(docking): Vina full-detail β€” parse 1.2.7 log (RMSD l.b./u.b., version, seed), RMSD table + run-config UI (3e)
4320faf

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feat(uniprot,domains): reviewed/organism filters + debounce/fast-path, PROSITE raw-sequence scan UI (3c,3d)
7acf89d

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feat(alignment): multi-method MSA (clustalo/muscle/kalign/mafft/tcoffee) with method selector (3b)
cc7ed3f

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feat(alignment): pairwise global/local alignment via BLAST hit 'Align pair' (3a)
f0992bc

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feat(md): verified force field/solvent menu (ff14SB/ff15ipq/ff19SB/amberfb15/CHARMM36 x OBC1/OBC2/GBN2) with alanine-dipeptide createSystem startup probe; explicit errors for invalid combos; dynamic frontend menu
2583376

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fix(blast): honor program/db/max_hits params, accept DNA queries, poll cap 65 min
1f75a84

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fix(md): reflect OXT across C-CA axis so GBSA stops NaNing on Linux CPU
d040f58

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fix(md): add missing C-terminal OXT so unterminated termini (1TIM HIS 248) build in OpenMM
a28c4bb

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fix(md): BioPython fallback crash on Atom.element.name ('str' object has no attribute 'name')
be32f12

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feat(md): temperature/KE, Rg and SASA traces; fix OpenMM in deployed image
8e3419e

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feat(md): real OpenMM production runs with accurate Ca RMSD
cbef588

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fix: harden BLAST pipeline against NCBI timeouts and server overload
2dadeea

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feat: expanded Domain & Motif Analysis with all features and cross-project links
9c0c10a

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test: comprehensive validation & fuzz testing with bug fixes
d17fdb8

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feat: add smoke-test suite β€” ADMET/MD/function/docking endpoint validation (27 tests)
5370232

Samad14 commited on