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skills/msa-search-nim/references/validation.md
1.05 KB · Sep 30, 2026 · 23:14 UTC
# MSA-Search Validation Validate that the search produced usable alignment or template artifacts before passing them downstream. ## Alignment Checks - `alignments` exists for standard search. - `alignments_by_chain` exists for paired search. - Each returned alignment has `alignment` text and a `format`. - A3M/FASTA text starts with FASTA-style headers. - Saved filenames include database and format so outputs do not overwrite each other. - Record database names and e-value used for the search. ## Template Checks - Template response includes `structures` and `search_hits`. - Save each returned structure as `.cif`. - Save M8 hit tables as `.m8` or `.tsv`. - Confirm `max_msa_sequences` matches `NIM_GLOBAL_MAX_MSA_DEPTH` for local GPU server mode. ## Scientific Warnings - Very shallow alignments may not improve downstream structure prediction. - Excessive near-duplicate sequences can bias an MSA. - Pairing failure can reduce complex-prediction usefulness. - Template hits should be inspected for coverage, e-value, and biological relevance before use.
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