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docs: sync WET_LAB_HANDOFF and ROADMAP with 7-scaffold pool - #78

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cschanhniem merged 2 commits into
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feat/wetlab-handoff-7seed-sync
Jun 28, 2026
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cschanhniem merged 2 commits into
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feat/wetlab-handoff-7seed-sync

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Summary

WET_LAB_HANDOFF.md

Change Before After
SEED-006 special notes "other 5 seeds" "other 6 seeds (magainin-like, cecropin-like, tachyplesin-like, Bac2A proline-rich, puroindoline Trp-rich)"
Serum stability heading "SEED-003, SEED-005, SEED-008" "SEED-001, SEED-003, SEED-005, SEED-008, SEED-009"
Seed family count "All 6 pilot panel seed families" "All 7 pilot panel seed families"
Flagged families "Three families" "Five families"
Stability table 3 rows 5 rows (added SEED-001, SEED-009)
SEED-006/SEED-007 scores "scores 0.61–0.67" "SEED-006 (scores 0.61–0.67) and SEED-007 (scores 0.64–0.66)"
SEED-001 special notes Missing Added full section: mechanism (carpet/toroidal pore), novelty caveat (low — positive control role), synthesis guidance (N-Ac + C-NH₂ both recommended), assay interpretation matrix

New stability table rows:

  • SEED-001 (score 0.49): natural magainin derivatives have documented serum t½ 15–30 min (Park & Hahm 2005) — score may be accurate, NOT a model underestimate. N-Ac/C-NH₂ recommended. D-Lys Wave 2 plan ready if t½ < 30 min.
  • SEED-009 (score 0.57): Pro-rich backbone resists protease cleavage 10–50× vs Lys/Arg-X bonds (Fischer & Spiess 1987). Model likely underestimates actual t½; Bac2A-type sequences show >2h stability in literature.

ROADMAP.md

External predictor row corrected:

Test plan

  • make test → 1245 passed
  • No code changes — documentation only
  • Verified serum stability scores computationally: SEED-001_VAR_064=0.4858, SEED-009 variants=0.5715
  • Wet-lab team should review SEED-001 special notes section before ordering

🤖 Generated with Claude Code

WET_LAB_HANDOFF.md was still referencing "6 pilot panel seed families"
after SEED-001 (magainin-1) was re-added as the 7th scaffold family in
PR #72. This PR corrects all stale counts and adds missing coverage for
the two newly relevant seeds.

Changes:
- "other 5 seeds" → "other 6 seeds" in SEED-006 special notes
- Serum stability section heading and body updated: 6→7 families,
  3→5 flagged families, SEED-001 and SEED-009 rows added to table
  - SEED-001 (score 0.49): natural magainin derivatives have documented
    serum t½ 15-30 min; model score may be accurate (not an underestimate);
    N-Ac/C-NH₂ modifications recommended in QC; D-Lys Wave 2 plan ready
  - SEED-009 (score 0.57): Pro-rich backbone resists protease cleavage
    10-50× vs Lys/Arg-X bonds; model likely underestimates actual t½
- SEED-006 and SEED-007 stability range corrected (0.61-0.67 / 0.64-0.66)
- Added SEED-001 (Magainin-1) Special Notes section: mechanism (carpet/
  toroidal pore), novelty caveat (low — serves as positive control),
  synthesis guidance (N-Ac + C-NH₂ both recommended), assay
  interpretation matrix including what SEED-001 inactivity means

ROADMAP.md:
- External predictor row updated: tool list corrected (CAMPR4, AMPScanner,
  dbAMP, AntiCP2, Macrel), checklist status noted, Macrel v1.6.0 CLI
  ONNX bug documented (all sequences misclassified as NAMP; use web server)
HIGH:
- Fix SEED-009 length contradiction: helix-wheel table showed "9 AA" while
  stability table (added this PR) correctly shows "12 AA"; aligned to 12 AA
  throughout (confirmed from pilot panel sequences)
- SEED-009 stability row: replace unsupported "10-50x slower" kinetic claim
  with mechanistic explanation — Pro nitrogen lacks free H for serine protease
  oxyanion hole (Pro-X bonds uncleaved); X-Pro bonds hindered by cis-trans
  isomerisation (Vanhoof et al. 1995, FASEB J 9:736-744)

MEDIUM:
- SEED-001 mechanism: distinguish toroidal-pore (primary, NMR-supported;
  Matsuzaki 1996, Huang 2006) from carpet mechanism (secondary at high conc;
  Brogden 2005); add assay signature guidance to help distinguish in vitro
- SEED-001 disagreement: document scorer conflict (activity=0.81 vs
  boman=0.43, disagreement=0.377) so wet-lab team can interpret potential
  inactivity
- SEED-003 stability: remove Radzishevsky 2007 (lipopeptides, not relevant
  to conventional short AMPs); reframe as known model calibration limitation
  for <15 AA sequences

LOW:
- N-Ac/C-NH2 claim: remove unsupported "2-3x" multiplier; keep qualitative
  statement that modifications reduce exopeptidase exposure
- ROADMAP: note AMPlify excluded due to GPU/ONNX env incompatibility
@cschanhniem
cschanhniem merged commit a8df6ef into main Jun 28, 2026
@cschanhniem
cschanhniem deleted the feat/wetlab-handoff-7seed-sync branch June 28, 2026 15:24
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