@pikaa-ai/pikaa 0.3.1 → 0.3.4

This diff represents the content of publicly available package versions that have been released to one of the supported registries. The information contained in this diff is provided for informational purposes only and reflects changes between package versions as they appear in their respective public registries.
Files changed (1870) hide show
  1. package/dist/cli.js +1169 -601
  2. package/dist/index.js +525 -204
  3. package/package.json +5 -3
  4. package/skills/adaptyv/references/api-endpoints.md +0 -690
  5. package/skills/aeon/references/anomaly_detection.md +0 -154
  6. package/skills/aeon/references/classification.md +0 -144
  7. package/skills/aeon/references/clustering.md +0 -123
  8. package/skills/aeon/references/datasets_benchmarking.md +0 -392
  9. package/skills/aeon/references/distances.md +0 -256
  10. package/skills/aeon/references/forecasting.md +0 -109
  11. package/skills/aeon/references/networks.md +0 -289
  12. package/skills/aeon/references/regression.md +0 -118
  13. package/skills/aeon/references/segmentation.md +0 -163
  14. package/skills/aeon/references/similarity_search.md +0 -187
  15. package/skills/aeon/references/transformations.md +0 -246
  16. package/skills/analytical-method-validation/assets/validation-protocol-template.md +0 -106
  17. package/skills/analytical-method-validation/assets/validation-report-template.md +0 -116
  18. package/skills/analytical-method-validation/references/compendial-and-clsi.md +0 -96
  19. package/skills/analytical-method-validation/references/framework-selection.md +0 -87
  20. package/skills/analytical-method-validation/references/ich-m10-bioanalytical.md +0 -123
  21. package/skills/analytical-method-validation/references/ich-q2r2.md +0 -229
  22. package/skills/analytical-method-validation/references/source-ledger.md +0 -125
  23. package/skills/analytical-method-validation/references/statistics.md +0 -209
  24. package/skills/analytical-method-validation/scripts/_catalog.py +0 -499
  25. package/skills/analytical-method-validation/scripts/_common.py +0 -955
  26. package/skills/analytical-method-validation/scripts/check_accuracy_precision.py +0 -328
  27. package/skills/analytical-method-validation/scripts/check_bioanalytical_run.py +0 -293
  28. package/skills/analytical-method-validation/scripts/check_detection_limits.py +0 -310
  29. package/skills/analytical-method-validation/scripts/check_response.py +0 -243
  30. package/skills/analytical-method-validation/scripts/compare_methods.py +0 -215
  31. package/skills/analytical-method-validation/scripts/plan_validation.py +0 -381
  32. package/skills/anndata/references/best_practices.md +0 -532
  33. package/skills/anndata/references/concatenation.md +0 -399
  34. package/skills/anndata/references/data_structure.md +0 -314
  35. package/skills/anndata/references/io_operations.md +0 -466
  36. package/skills/anndata/references/manipulation.md +0 -516
  37. package/skills/arbor/references/arbor-upstream.md +0 -91
  38. package/skills/arbor/references/executor-brief.md +0 -68
  39. package/skills/arbor/references/htr-methodology.md +0 -177
  40. package/skills/arbor/references/report-template.md +0 -39
  41. package/skills/arbor/scripts/tree.py +0 -564
  42. package/skills/arboreto/references/algorithms.md +0 -152
  43. package/skills/arboreto/references/basic_inference.md +0 -181
  44. package/skills/arboreto/references/distributed_computing.md +0 -242
  45. package/skills/arboreto/scripts/basic_grn_inference.py +0 -107
  46. package/skills/astropy/references/coordinates.md +0 -280
  47. package/skills/astropy/references/cosmology.md +0 -309
  48. package/skills/astropy/references/fits.md +0 -398
  49. package/skills/astropy/references/tables.md +0 -495
  50. package/skills/astropy/references/time.md +0 -412
  51. package/skills/astropy/references/units.md +0 -178
  52. package/skills/astropy/references/wcs_and_other_modules.md +0 -377
  53. package/skills/autoskill/config.yaml +0 -53
  54. package/skills/autoskill/references/https-proxy.md +0 -62
  55. package/skills/autoskill/references/screenpipe-config.yaml +0 -61
  56. package/skills/autoskill/scripts/autoskill.py +0 -35
  57. package/skills/autoskill/scripts/backends.py +0 -116
  58. package/skills/autoskill/scripts/cluster.py +0 -54
  59. package/skills/autoskill/scripts/doctor.py +0 -108
  60. package/skills/autoskill/scripts/fetch_window.py +0 -33
  61. package/skills/autoskill/scripts/match_skills.py +0 -46
  62. package/skills/autoskill/scripts/promote.py +0 -58
  63. package/skills/autoskill/scripts/redact.py +0 -40
  64. package/skills/autoskill/scripts/run.py +0 -194
  65. package/skills/autoskill/scripts/synthesize.py +0 -72
  66. package/skills/benchling-integration/references/api_endpoints.md +0 -883
  67. package/skills/benchling-integration/references/authentication.md +0 -390
  68. package/skills/benchling-integration/references/core_capabilities.md +0 -355
  69. package/skills/benchling-integration/references/eventbridge.md +0 -255
  70. package/skills/benchling-integration/references/sdk_reference.md +0 -772
  71. package/skills/bids/references/beps.yml +0 -637
  72. package/skills/bids/references/bids_schema.json +0 -21015
  73. package/skills/bids/references/bids_specification.md +0 -165
  74. package/skills/bids/references/conversion_tools.md +0 -475
  75. package/skills/bids/references/core_workflows.md +0 -552
  76. package/skills/bids/references/metadata_fields.md +0 -365
  77. package/skills/bids/scripts/update_schema.py +0 -89
  78. package/skills/biopython/references/advanced.md +0 -580
  79. package/skills/biopython/references/alignment.md +0 -377
  80. package/skills/biopython/references/blast.md +0 -463
  81. package/skills/biopython/references/databases.md +0 -492
  82. package/skills/biopython/references/phylogenetics.md +0 -566
  83. package/skills/biopython/references/sequence_io.md +0 -289
  84. package/skills/biopython/references/structure.md +0 -564
  85. package/skills/bioservices/references/identifier_mapping.md +0 -685
  86. package/skills/bioservices/references/services_reference.md +0 -638
  87. package/skills/bioservices/references/workflow_patterns.md +0 -813
  88. package/skills/bioservices/scripts/batch_id_converter.py +0 -347
  89. package/skills/bioservices/scripts/compound_cross_reference.py +0 -387
  90. package/skills/bioservices/scripts/pathway_analysis.py +0 -309
  91. package/skills/bioservices/scripts/protein_analysis_workflow.py +0 -441
  92. package/skills/bulk-rnaseq/references/counts-and-handoff.md +0 -91
  93. package/skills/bulk-rnaseq/references/design-and-qc.md +0 -68
  94. package/skills/bulk-rnaseq/references/upstream-manual.md +0 -128
  95. package/skills/bulk-rnaseq/references/upstream-nfcore.md +0 -108
  96. package/skills/bulk-rnaseq/scripts/build_counts_matrix.py +0 -203
  97. package/skills/bulk-rnaseq/scripts/validate_samplesheet.py +0 -206
  98. package/skills/cellxgene-census/references/census_schema.md +0 -218
  99. package/skills/cellxgene-census/references/common_patterns.md +0 -368
  100. package/skills/cellxgene-census/references/core_workflow_patterns.md +0 -297
  101. package/skills/cirq/references/building.md +0 -307
  102. package/skills/cirq/references/experiments.md +0 -572
  103. package/skills/cirq/references/hardware.md +0 -527
  104. package/skills/cirq/references/noise.md +0 -514
  105. package/skills/cirq/references/simulation.md +0 -353
  106. package/skills/cirq/references/transformation.md +0 -416
  107. package/skills/citation-management/assets/bibtex_template.bib +0 -264
  108. package/skills/citation-management/assets/citation_checklist.md +0 -386
  109. package/skills/citation-management/references/best_practices.md +0 -91
  110. package/skills/citation-management/references/bibtex_formatting.md +0 -908
  111. package/skills/citation-management/references/citation_validation.md +0 -835
  112. package/skills/citation-management/references/core_workflow.md +0 -569
  113. package/skills/citation-management/references/example_workflows.md +0 -126
  114. package/skills/citation-management/references/google_scholar_search.md +0 -732
  115. package/skills/citation-management/references/metadata_extraction.md +0 -870
  116. package/skills/citation-management/references/pubmed_search.md +0 -839
  117. package/skills/citation-management/references/script_reference.md +0 -250
  118. package/skills/citation-management/references/search_strategies.md +0 -110
  119. package/skills/citation-management/scripts/_common.py +0 -331
  120. package/skills/citation-management/scripts/doi_to_bibtex.py +0 -204
  121. package/skills/citation-management/scripts/extract_metadata.py +0 -690
  122. package/skills/citation-management/scripts/format_bibtex.py +0 -356
  123. package/skills/citation-management/scripts/search_google_scholar.py +0 -268
  124. package/skills/citation-management/scripts/search_openalex.py +0 -297
  125. package/skills/citation-management/scripts/search_pubmed.py +0 -419
  126. package/skills/citation-management/scripts/validate_citations.py +0 -688
  127. package/skills/clinical-decision-support/assets/aggregate_cohort_table_template.json +0 -114
  128. package/skills/clinical-decision-support/assets/aggregate_model_evaluation_template.json +0 -115
  129. package/skills/clinical-decision-support/assets/artifact_intended_use_template.json +0 -81
  130. package/skills/clinical-decision-support/assets/decision_logic_traceability_template.json +0 -108
  131. package/skills/clinical-decision-support/assets/deidentification_checklist_template.json +0 -176
  132. package/skills/clinical-decision-support/assets/evidence_profile_template.json +0 -139
  133. package/skills/clinical-decision-support/assets/survival_analysis_plan_template.json +0 -134
  134. package/skills/clinical-decision-support/references/cohort_evaluation.md +0 -142
  135. package/skills/clinical-decision-support/references/decision_logic_traceability.md +0 -146
  136. package/skills/clinical-decision-support/references/evidence_profiles.md +0 -153
  137. package/skills/clinical-decision-support/references/model_biomarker_evaluation.md +0 -152
  138. package/skills/clinical-decision-support/references/privacy_and_disclosure.md +0 -144
  139. package/skills/clinical-decision-support/references/regulatory_and_governance.md +0 -104
  140. package/skills/clinical-decision-support/references/safety_and_scope.md +0 -103
  141. package/skills/clinical-decision-support/references/security_validation.md +0 -60
  142. package/skills/clinical-decision-support/references/sources.md +0 -119
  143. package/skills/clinical-decision-support/references/study_reporting.md +0 -134
  144. package/skills/clinical-decision-support/references/survival_analysis.md +0 -156
  145. package/skills/clinical-decision-support/scripts/_common.py +0 -223
  146. package/skills/clinical-decision-support/scripts/cohort_table_generator.py +0 -288
  147. package/skills/clinical-decision-support/scripts/decision_logic_traceability.py +0 -313
  148. package/skills/clinical-decision-support/scripts/deidentification_checklist.py +0 -260
  149. package/skills/clinical-decision-support/scripts/evidence_profile_check.py +0 -259
  150. package/skills/clinical-decision-support/scripts/model_biomarker_evaluation.py +0 -345
  151. package/skills/clinical-decision-support/scripts/survival_plan_validator.py +0 -294
  152. package/skills/clinical-decision-support/scripts/validate_cds_artifact.py +0 -269
  153. package/skills/clinical-reports/assets/adverse_event_aggregate_input_template.csv +0 -1
  154. package/skills/clinical-reports/assets/case_report_template.json +0 -43
  155. package/skills/clinical-reports/assets/clinical_trial_csr_template.json +0 -51
  156. package/skills/clinical-reports/assets/clinical_trial_results_template.json +0 -66
  157. package/skills/clinical-reports/assets/clinical_trial_safety_aggregate_template.json +0 -49
  158. package/skills/clinical-reports/assets/consistency_manifest_template.json +0 -15
  159. package/skills/clinical-reports/assets/deidentification_process_checklist.json +0 -56
  160. package/skills/clinical-reports/assets/lab_report_template.json +0 -36
  161. package/skills/clinical-reports/assets/pathology_report_template.json +0 -36
  162. package/skills/clinical-reports/assets/provenance_manifest_template.json +0 -17
  163. package/skills/clinical-reports/assets/quality_review_checklist.json +0 -34
  164. package/skills/clinical-reports/assets/radiology_report_template.json +0 -34
  165. package/skills/clinical-reports/assets/research_summary_template.json +0 -36
  166. package/skills/clinical-reports/assets/terminology_manifest_template.json +0 -11
  167. package/skills/clinical-reports/assets/trial_protocol_reporting_checklist.json +0 -70
  168. package/skills/clinical-reports/references/case_report_guidelines.md +0 -72
  169. package/skills/clinical-reports/references/clinical_trial_reporting.md +0 -97
  170. package/skills/clinical-reports/references/data_presentation.md +0 -92
  171. package/skills/clinical-reports/references/diagnostic_reports_standards.md +0 -76
  172. package/skills/clinical-reports/references/medical_terminology.md +0 -84
  173. package/skills/clinical-reports/references/privacy_and_deidentification.md +0 -84
  174. package/skills/clinical-reports/references/professional_review.md +0 -78
  175. package/skills/clinical-reports/references/report_type_routing.md +0 -57
  176. package/skills/clinical-reports/references/safety_reporting.md +0 -109
  177. package/skills/clinical-reports/references/sources.md +0 -75
  178. package/skills/clinical-reports/scripts/_common.py +0 -263
  179. package/skills/clinical-reports/scripts/check_deidentification.py +0 -298
  180. package/skills/clinical-reports/scripts/consistency_checker.py +0 -390
  181. package/skills/clinical-reports/scripts/format_adverse_events.py +0 -455
  182. package/skills/clinical-reports/scripts/generate_report_template.py +0 -115
  183. package/skills/clinical-reports/scripts/provenance_validator.py +0 -263
  184. package/skills/clinical-reports/scripts/terminology_validator.py +0 -277
  185. package/skills/clinical-reports/scripts/validate_case_report.py +0 -278
  186. package/skills/clinical-reports/scripts/validate_trial_report.py +0 -534
  187. package/skills/cobrapy/references/api_quick_reference.md +0 -665
  188. package/skills/cobrapy/references/workflows.md +0 -600
  189. package/skills/consciousness-council/references/advanced-configurations.md +0 -96
  190. package/skills/dask/references/arrays.md +0 -495
  191. package/skills/dask/references/bags.md +0 -468
  192. package/skills/dask/references/best-practices.md +0 -277
  193. package/skills/dask/references/dataframes.md +0 -370
  194. package/skills/dask/references/futures.md +0 -541
  195. package/skills/dask/references/schedulers.md +0 -517
  196. package/skills/database-lookup/references/addgene.md +0 -38
  197. package/skills/database-lookup/references/alphafold.md +0 -52
  198. package/skills/database-lookup/references/alphavantage.md +0 -261
  199. package/skills/database-lookup/references/bea.md +0 -409
  200. package/skills/database-lookup/references/bindingdb.md +0 -85
  201. package/skills/database-lookup/references/biogrid.md +0 -110
  202. package/skills/database-lookup/references/bls.md +0 -235
  203. package/skills/database-lookup/references/brenda.md +0 -71
  204. package/skills/database-lookup/references/cbioportal.md +0 -206
  205. package/skills/database-lookup/references/census.md +0 -251
  206. package/skills/database-lookup/references/chebi.md +0 -103
  207. package/skills/database-lookup/references/chembl.md +0 -80
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  210. package/skills/database-lookup/references/clinvar.md +0 -91
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  212. package/skills/database-lookup/references/cosmic.md +0 -59
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  218. package/skills/database-lookup/references/drugbank.md +0 -54
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  229. package/skills/database-lookup/references/gene-ontology.md +0 -147
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  236. package/skills/database-lookup/references/human-protein-atlas.md +0 -57
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@@ -1,733 +0,0 @@
1
- # gget Module Catalog
2
-
3
- Every module by category, with its parameters and both command-line and Python examples.
4
- This is the usage-oriented cut; see `module_reference.md` for the fuller per-parameter
5
- reference and `database_info.md` for the underlying data sources.
6
-
7
- ## Module Categories
8
-
9
- ### 1. Reference & Gene Information
10
-
11
- #### gget ref - Reference Genome Downloads
12
-
13
- Retrieve download links and metadata for Ensembl reference genomes.
14
-
15
- **Parameters**:
16
- - `species`: Genus_species format (e.g., 'homo_sapiens', 'mus_musculus'). Shortcuts: 'human', 'mouse'
17
- - `-w/--which`: Specify return types as comma-separated CLI values or Python list (gtf, cdna, dna, cds, cdrna, pep). Default: all
18
- - `-r/--release`: Ensembl release number (default: latest)
19
- - `-od/--out_dir`: Directory for downloaded files
20
- - `-l/--list_species`: List available vertebrate species
21
- - `-liv/--list_iv_species`: List available invertebrate species
22
- - `-ftp`: Return only FTP links
23
- - `-d/--download`: Download files (requires curl)
24
-
25
- **Examples**:
26
- ```bash
27
- # List available species
28
- gget ref --list_species
29
-
30
- # Get all reference files for human
31
- gget ref homo_sapiens
32
-
33
- # Download GTF and cDNA files for mouse
34
- gget ref -w gtf,cdna -d mouse
35
- ```
36
-
37
- ```python
38
- # Python
39
- gget.ref("homo_sapiens")
40
- gget.ref("mus_musculus", which=["gtf", "cdna"], download=True)
41
- ```
42
-
43
- #### gget search - Gene Search
44
-
45
- Locate genes by name, description, and Ensembl synonyms across species.
46
-
47
- **Parameters**:
48
- - `searchwords`: One or more search terms (case-insensitive)
49
- - `-s/--species`: Target species (e.g., 'homo_sapiens', 'mouse')
50
- - `-r/--release`: Ensembl release number
51
- - `-t/--id_type`: Return 'gene' (default) or 'transcript'
52
- - `-ao/--andor`: 'or' (default) finds ANY searchword; 'and' requires ALL
53
- - `-l/--limit`: Maximum results to return
54
- - `wrap_text`: Python-only display helper for wide DataFrames
55
-
56
- **Returns**: ensembl_id, gene_name, ensembl_description, ext_ref_description, biotype, URL
57
-
58
- **Examples**:
59
- ```bash
60
- # Search for GABA-related genes in human
61
- gget search -s human gaba gamma-aminobutyric
62
-
63
- # Find specific gene, require all terms
64
- gget search -s mouse -ao and pax7 transcription
65
- ```
66
-
67
- ```python
68
- # Python
69
- gget.search(["gaba", "gamma-aminobutyric"], species="homo_sapiens")
70
- ```
71
-
72
- #### gget info - Gene/Transcript Information
73
-
74
- Retrieve comprehensive gene and transcript metadata from Ensembl, UniProt, and NCBI.
75
-
76
- **Parameters**:
77
- - `ens_ids`: One or more Ensembl IDs (also supports WormBase, Flybase IDs). Limit: ~1000 IDs
78
- - `-n/--ncbi`: Disable NCBI data retrieval
79
- - `-u/--uniprot`: Disable UniProt data retrieval
80
- - `-pdb`: Include PDB identifiers (increases runtime)
81
-
82
- **Returns**: UniProt ID, NCBI gene ID, primary gene name, synonyms, protein names, descriptions, biotype, canonical transcript
83
-
84
- **Examples**:
85
- ```bash
86
- # Get info for multiple genes
87
- gget info ENSG00000034713 ENSG00000104853 ENSG00000170296
88
-
89
- # Include PDB IDs
90
- gget info ENSG00000034713 -pdb
91
- ```
92
-
93
- ```python
94
- # Python
95
- gget.info(["ENSG00000034713", "ENSG00000104853"], pdb=True)
96
- ```
97
-
98
- #### gget seq - Sequence Retrieval
99
-
100
- Fetch nucleotide or amino acid sequences for genes and transcripts.
101
-
102
- **Parameters**:
103
- - `ens_ids`: One or more Ensembl identifiers
104
- - `-t/--translate`: Fetch amino acid sequences instead of nucleotide
105
- - `-iso/--isoforms`: Return all transcript variants (gene IDs only)
106
-
107
- **Returns**: FASTA format sequences
108
-
109
- **Examples**:
110
- ```bash
111
- # Get nucleotide sequences
112
- gget seq ENSG00000034713 ENSG00000104853
113
-
114
- # Get all protein isoforms
115
- gget seq -t -iso ENSG00000034713
116
- ```
117
-
118
- ```python
119
- # Python
120
- gget.seq(["ENSG00000034713"], translate=True, isoforms=True)
121
- ```
122
-
123
- ### 2. Sequence Analysis & Alignment
124
-
125
- #### gget blast - BLAST Searches
126
-
127
- BLAST nucleotide or amino acid sequences against standard databases.
128
-
129
- **Parameters**:
130
- - `sequence`: Sequence string or path to FASTA/.txt file
131
- - `-p/--program`: blastn, blastp, blastx, tblastn, tblastx (auto-detected)
132
- - `-db/--database`:
133
- - Nucleotide: nt, refseq_rna, pdbnt
134
- - Protein: nr, swissprot, pdbaa, refseq_protein
135
- - `-l/--limit`: Max hits (default: 50)
136
- - `-e/--expect`: E-value cutoff (default: 10.0)
137
- - `-lcf/--low_comp_filt`: Enable low complexity filtering
138
- - `-mbo/--megablast_off`: Disable MegaBLAST (blastn only)
139
-
140
- **Examples**:
141
- ```bash
142
- # BLAST protein sequence
143
- gget blast MKWMFKEDHSLEHRCVESAKIRAKYPDRVPVIVEKVSGSQIVDIDKRKYLVPSDITVAQFMWIIRKRIQLPSEKAIFLFVDKTVPQSR
144
-
145
- # BLAST from file with specific database
146
- gget blast sequence.fasta -db swissprot -l 10
147
- ```
148
-
149
- ```python
150
- # Python
151
- gget.blast("MKWMFK...", database="swissprot", limit=10)
152
- ```
153
-
154
- #### gget blat - BLAT Searches
155
-
156
- Locate genomic positions of sequences using UCSC BLAT.
157
-
158
- **Parameters**:
159
- - `sequence`: Sequence string or path to FASTA/.txt file
160
- - `-st/--seqtype`: 'DNA', 'protein', 'translated%20RNA', 'translated%20DNA' (auto-detected)
161
- - `-a/--assembly`: Target assembly (default: 'human'/hg38; options: 'mouse'/mm39, 'zebrafinch'/taeGut2, etc.)
162
-
163
- **Returns**: genome, query size, alignment positions, matches, mismatches, alignment percentage
164
-
165
- **Examples**:
166
- ```bash
167
- # Find genomic location in human
168
- gget blat ATCGATCGATCGATCG
169
-
170
- # Search in different assembly
171
- gget blat -a mm39 ATCGATCGATCGATCG
172
- ```
173
-
174
- ```python
175
- # Python
176
- gget.blat("ATCGATCGATCGATCG", assembly="mouse")
177
- ```
178
-
179
- #### gget muscle - Multiple Sequence Alignment
180
-
181
- Align multiple nucleotide or amino acid sequences using Muscle5.
182
-
183
- **Parameters**:
184
- - `fasta`: Sequences or path to FASTA/.txt file
185
- - `-s5/--super5`: Use Super5 algorithm for faster processing (large datasets)
186
-
187
- **Returns**: Aligned sequences in ClustalW format or aligned FASTA (.afa)
188
-
189
- **Examples**:
190
- ```bash
191
- # Align sequences from file
192
- gget muscle sequences.fasta -o aligned.afa
193
-
194
- # Use Super5 for large dataset
195
- gget muscle large_dataset.fasta -s5
196
- ```
197
-
198
- ```python
199
- # Python
200
- gget.muscle("sequences.fasta", save=True)
201
- ```
202
-
203
- #### gget diamond - Local Sequence Alignment
204
-
205
- Perform fast local protein alignment or translated nucleotide-to-protein alignment using DIAMOND.
206
-
207
- **Parameters**:
208
- - Query: Sequences (string/list) or FASTA file path
209
- - `-ref/--reference`: Reference sequences (string/list) or FASTA file path (required)
210
- - `-s/--sensitivity`: fast, mid-sensitive, sensitive, more-sensitive, very-sensitive (default), ultra-sensitive
211
- - `-t/--threads`: CPU threads (default: 1)
212
- - `-db/--diamond_db`: Save database for reuse
213
- - `-x/--translated`: Enable nucleotide query to amino acid reference alignment
214
-
215
- **Returns**: Identity percentage, sequence lengths, match positions, gap openings, E-values, bit scores
216
-
217
- **Examples**:
218
- ```bash
219
- # Align against reference
220
- gget diamond GGETISAWESQME -ref reference.fasta -t 4
221
-
222
- # Translate nucleotide query against amino acid reference
223
- gget diamond query_nt.fasta -ref proteins.fasta --translated
224
- ```
225
-
226
- ```python
227
- # Python
228
- gget.diamond("GGETISAWESQME", reference="reference.fasta", threads=4)
229
- gget.diamond("ATGGGC...", reference="proteins.fasta", translated=True)
230
- ```
231
-
232
- ### 3. Structural & Protein Analysis
233
-
234
- #### gget pdb - Protein Structures
235
-
236
- Query RCSB Protein Data Bank for structure and metadata.
237
-
238
- **Parameters**:
239
- - `pdb_id`: PDB identifier (e.g., '7S7U')
240
- - `-r/--resource`: Data type (pdb, entry, pubmed, assembly, entity types)
241
- - `-i/--identifier`: Assembly, entity, or chain ID
242
-
243
- **Returns**: PDB format (structures) or JSON (metadata)
244
-
245
- **Examples**:
246
- ```bash
247
- # Download PDB structure
248
- gget pdb 7S7U -o 7S7U.pdb
249
-
250
- # Get metadata
251
- gget pdb 7S7U -r entry
252
- ```
253
-
254
- ```python
255
- # Python
256
- gget.pdb("7S7U", save=True)
257
- ```
258
-
259
- #### gget alphafold - Protein Structure Prediction
260
-
261
- Predict 3D protein structures using simplified AlphaFold2.
262
-
263
- **Setup Required**:
264
- ```bash
265
- # Installs modified third-party dependencies and downloads model parameters
266
- gget setup alphafold
267
- ```
268
-
269
- **Parameters**:
270
- - `sequence`: Amino acid sequence (string), multiple sequences (list), or FASTA file. Multiple sequences trigger multimer modeling
271
- - `-mr/--multimer_recycles`: Recycling iterations (default: 3; recommend 20 for accuracy)
272
- - `-mfm/--multimer_for_monomer`: Apply multimer model to single proteins
273
- - `-r/--relax`: AMBER relaxation for top-ranked model
274
- - `plot`: Python-only; generate interactive 3D visualization (default: True)
275
- - `show_sidechains`: Python-only; include side chains (default: True)
276
-
277
- **Returns**: PDB structure file, JSON alignment error data, optional 3D visualization
278
-
279
- **Examples**:
280
- ```bash
281
- # Predict single protein structure
282
- gget alphafold MKWMFKEDHSLEHRCVESAKIRAKYPDRVPVIVEKVSGSQIVDIDKRKYLVPSDITVAQFMWIIRKRIQLPSEKAIFLFVDKTVPQSR
283
-
284
- # Predict multimer with higher accuracy
285
- gget alphafold sequence1.fasta -mr 20 -r
286
- ```
287
-
288
- ```python
289
- # Python with visualization
290
- gget.alphafold("MKWMFK...", plot=True, show_sidechains=True)
291
-
292
- # Multimer prediction
293
- gget.alphafold(["sequence1", "sequence2"], multimer_recycles=20)
294
- ```
295
-
296
- #### gget elm - Eukaryotic Linear Motifs
297
-
298
- Predict Eukaryotic Linear Motifs in protein sequences.
299
-
300
- **Setup Required**:
301
- ```bash
302
- gget setup elm
303
- ```
304
-
305
- **Parameters**:
306
- - `sequence`: Amino acid sequence or UniProt Acc
307
- - `-u/--uniprot`: Indicates sequence is UniProt Acc
308
- - `-e/--expand`: Include protein names, organisms, references
309
- - `-s/--sensitivity`: DIAMOND alignment sensitivity (default: "very-sensitive")
310
- - `-t/--threads`: Number of threads (default: 1)
311
-
312
- **Returns**: Two outputs:
313
- 1. **ortholog_df**: Linear motifs from orthologous proteins
314
- 2. **regex_df**: Motifs directly matched in input sequence
315
-
316
- **Examples**:
317
- ```bash
318
- # Predict motifs from sequence
319
- gget elm LIAQSIGQASFV -o results
320
-
321
- # Use UniProt accession with expanded info
322
- gget elm --uniprot Q02410 -e
323
- ```
324
-
325
- ```python
326
- # Python
327
- ortholog_df, regex_df = gget.elm("LIAQSIGQASFV")
328
- ```
329
-
330
- ### 4. Expression & Disease Data
331
-
332
- #### gget archs4 - Gene Correlation & Tissue Expression
333
-
334
- Query ARCHS4 database for correlated genes or tissue expression data.
335
-
336
- **Parameters**:
337
- - `gene`: Gene symbol or Ensembl ID (with `--ensembl` flag)
338
- - `-w/--which`: 'correlation' (default, returns 100 most correlated genes) or 'tissue' (expression atlas)
339
- - `-s/--species`: 'human' (default) or 'mouse' (tissue data only)
340
- - `-e/--ensembl`: Input is Ensembl ID
341
-
342
- **Returns**:
343
- - **Correlation mode**: Gene symbols, Pearson correlation coefficients
344
- - **Tissue mode**: Tissue identifiers, min/Q1/median/Q3/max expression values
345
-
346
- **Examples**:
347
- ```bash
348
- # Get correlated genes
349
- gget archs4 ACE2
350
-
351
- # Get tissue expression
352
- gget archs4 -w tissue ACE2
353
- ```
354
-
355
- ```python
356
- # Python
357
- gget.archs4("ACE2", which="tissue")
358
- ```
359
-
360
- #### gget cellxgene - Single-Cell RNA-seq Data
361
-
362
- Query CZ CELLxGENE Discover Census for single-cell data.
363
-
364
- **Setup Required**:
365
- ```bash
366
- gget setup cellxgene
367
- ```
368
-
369
- **Parameters**:
370
- - `--gene` (-g): Gene names or Ensembl IDs (case-sensitive! 'PAX7' for human, 'Pax7' for mouse)
371
- - `--tissue`: Tissue type(s)
372
- - `--cell_type`: Specific cell type(s)
373
- - `--species` (-s): 'homo_sapiens' (default) or 'mus_musculus'
374
- - `--census_version` (-cv): Version ("stable", "latest", or dated)
375
- - `--ensembl` (-e): Use Ensembl IDs
376
- - `--meta_only` (-mo): Return metadata only
377
- - Additional filters: disease, development_stage, sex, assay, dataset_id, donor_id, ethnicity, suspension_type
378
-
379
- **Returns**: AnnData object with count matrices and metadata (or metadata-only dataframes)
380
-
381
- **Examples**:
382
- ```bash
383
- # Get single-cell data for specific genes and cell types
384
- gget cellxgene --gene ACE2 ABCA1 --tissue lung --cell_type "mucus secreting cell" -o lung_data.h5ad
385
-
386
- # Metadata only
387
- gget cellxgene --gene PAX7 --tissue muscle --meta_only -o metadata.csv
388
- ```
389
-
390
- ```python
391
- # Python
392
- adata = gget.cellxgene(gene=["ACE2", "ABCA1"], tissue="lung", cell_type="mucus secreting cell")
393
- ```
394
-
395
- #### gget enrichr - Enrichment Analysis
396
-
397
- Perform ontology enrichment analysis on gene lists using Enrichr.
398
-
399
- **Parameters**:
400
- - `genes`: Gene symbols or Ensembl IDs
401
- - `-db/--database`: Reference database (supports shortcuts: 'pathway', 'transcription', 'ontology', 'diseases_drugs', 'celltypes')
402
- - `-s/--species`: human (default), mouse, fly, yeast, worm, fish
403
- - `-bkg_l/--background_list`: Background genes for comparison
404
- - `-ko/--kegg_out`: Save KEGG pathway images with highlighted genes
405
- - `plot`: Python-only; generate graphical results
406
-
407
- **Database Shortcuts**:
408
- - 'pathway' → KEGG_2021_Human
409
- - 'transcription' → ChEA_2016
410
- - 'ontology' → GO_Biological_Process_2021
411
- - 'diseases_drugs' → GWAS_Catalog_2019
412
- - 'celltypes' → PanglaoDB_Augmented_2021
413
-
414
- **Examples**:
415
- ```bash
416
- # Enrichment analysis for ontology
417
- gget enrichr -db ontology ACE2 AGT AGTR1
418
-
419
- # Save KEGG pathways
420
- gget enrichr -db pathway ACE2 AGT AGTR1 -ko ./kegg_images/
421
- ```
422
-
423
- ```python
424
- # Python with plot
425
- gget.enrichr(["ACE2", "AGT", "AGTR1"], database="ontology", plot=True)
426
- ```
427
-
428
- #### gget bgee - Orthology & Expression
429
-
430
- Retrieve orthology and gene expression data from Bgee database.
431
-
432
- **Parameters**:
433
- - `ens_id`: Ensembl gene ID or NCBI gene ID (for non-Ensembl species). Multiple IDs supported when `type=expression`
434
- - `-t/--type`: 'orthologs' (default) or 'expression'
435
-
436
- **Returns**:
437
- - **Orthologs mode**: Matching genes across species with IDs, names, taxonomic info
438
- - **Expression mode**: Anatomical entities, confidence scores, expression status
439
-
440
- **Examples**:
441
- ```bash
442
- # Get orthologs
443
- gget bgee ENSG00000169194
444
-
445
- # Get expression data
446
- gget bgee ENSG00000169194 -t expression
447
-
448
- # Multiple genes
449
- gget bgee ENSBTAG00000047356 ENSBTAG00000018317 -t expression
450
- ```
451
-
452
- ```python
453
- # Python
454
- gget.bgee("ENSG00000169194", type="orthologs")
455
- ```
456
-
457
- #### gget opentargets - Disease & Drug Associations
458
-
459
- Retrieve disease and drug associations from OpenTargets.
460
-
461
- **Parameters**:
462
- - Ensembl gene ID (required)
463
- - `-r/--resource`: diseases (default), drugs, tractability, pharmacogenetics, expression, depmap, interactions
464
- - `-l/--limit`: Cap results count
465
- - `--filters`: Exact-match filters using returned OpenTargets column names; repeat on the CLI or pass a Python dict
466
- - `-or/--or`: CLI-only; combine filters with OR logic instead of the default AND logic
467
-
468
- **Current notes**:
469
- - gget 0.30.5 rewrote this module for the newer OpenTargets API; some output column names differ from older releases.
470
- - The older `--filter_mode` argument was removed upstream.
471
-
472
- **Examples**:
473
- ```bash
474
- # Get associated diseases
475
- gget opentargets ENSG00000169194 -r diseases -l 5
476
-
477
- # Get associated drugs
478
- gget opentargets ENSG00000169194 -r drugs -l 10
479
-
480
- # Filter interactions by returned column names
481
- gget opentargets ENSG00000169194 -r interactions --filters protein_a_id=P35225 --filters gene_b_id=ENSG00000077238
482
- ```
483
-
484
- ```python
485
- # Python
486
- gget.opentargets("ENSG00000169194", resource="diseases", limit=5)
487
- gget.opentargets(
488
- "ENSG00000169194",
489
- resource="interactions",
490
- filters={"protein_a_id": "P35225", "gene_b_id": "ENSG00000077238"},
491
- )
492
- ```
493
-
494
- #### gget cbio - cBioPortal Cancer Genomics
495
-
496
- Plot cancer genomics heatmaps using cBioPortal data.
497
-
498
- **Two subcommands**:
499
-
500
- **search** - Find study IDs:
501
- ```bash
502
- gget cbio search breast lung
503
- ```
504
-
505
- **plot** - Generate heatmaps:
506
-
507
- **Parameters**:
508
- - `-s/--study_ids`: Space-separated cBioPortal study IDs (required)
509
- - `-g/--genes`: Space-separated gene names or Ensembl IDs (required)
510
- - `-st/--stratification`: Column to organize data (tissue, cancer_type, cancer_type_detailed, study_id, sample)
511
- - `-vt/--variation_type`: Data type (mutation_occurrences, cna_nonbinary, sv_occurrences, cna_occurrences, Consequence)
512
- - `-f/--filter`: Filter by column value (e.g., 'study_id:msk_impact_2017')
513
- - `-dd/--data_dir`: Cache directory (default: ./gget_cbio_cache)
514
- - `-fd/--figure_dir`: Output directory (default: ./gget_cbio_figures)
515
- - `-dpi`: Resolution (default: 100)
516
- - `-sh/--show`: Display plot in window
517
- - `-nc/--no_confirm`: Skip download confirmations
518
-
519
- **Examples**:
520
- ```bash
521
- # Search for studies
522
- gget cbio search esophag ovary
523
-
524
- # Create heatmap
525
- gget cbio plot -s msk_impact_2017 -g AKT1 ALK BRAF -st tissue -vt mutation_occurrences
526
- ```
527
-
528
- ```python
529
- # Python
530
- gget.cbio_search(["esophag", "ovary"])
531
- gget.cbio_plot(["msk_impact_2017"], ["AKT1", "ALK"], stratification="tissue")
532
- ```
533
-
534
- #### gget cosmic - COSMIC Database
535
-
536
- Search COSMIC (Catalogue Of Somatic Mutations In Cancer) database.
537
-
538
- **Important**: License fees apply for commercial use. Requires COSMIC account credentials.
539
- Avoid passing COSMIC credentials directly as CLI arguments on shared systems because command-line arguments can be exposed in shell history, process listings, and logs. Prefer the interactive prompt (`gget cosmic --download_cosmic ...`) or named environment variables read inside Python.
540
-
541
- **Parameters**:
542
- - `searchterm`: Gene name, Ensembl ID, mutation notation, or sample ID
543
- - `-ctp/--cosmic_tsv_path`: Path to downloaded COSMIC TSV file (required for querying)
544
- - `-l/--limit`: Maximum results (default: 100)
545
-
546
- **Database download flags**:
547
- - `-d/--download_cosmic`: Activate download mode
548
- - `-gm/--gget_mutate`: Create version for gget mutate
549
- - `-cp/--cosmic_project`: Database type (cancer, cancer_example, census, cell_line, resistance, genome_screen, targeted_screen)
550
- - `-cv/--cosmic_version`: COSMIC version
551
- - `-gv/--grch_version`: Human reference genome (37 or 38)
552
- - `--email`, `--password`: COSMIC credentials for non-interactive downloads; prefer prompt or Python env vars
553
-
554
- **Examples**:
555
- ```bash
556
- # First download database; gget prompts for COSMIC email/password
557
- gget cosmic --download_cosmic --cosmic_project cancer
558
-
559
- # Then query
560
- gget cosmic EGFR --cosmic_tsv_path "CancerMutationCensus_AllData_Tsv_v101_GRCh37/CancerMutationCensus_AllData_v101_GRCh37.tsv" -l 10
561
- ```
562
-
563
- ```python
564
- # Python
565
- import os
566
-
567
- gget.cosmic(
568
- searchterm=None,
569
- download_cosmic=True,
570
- cosmic_project="cancer",
571
- email=os.environ["COSMIC_EMAIL"],
572
- password=os.environ["COSMIC_PASSWORD"],
573
- )
574
- gget.cosmic("EGFR", cosmic_tsv_path="cosmic_data.tsv", limit=10)
575
- ```
576
-
577
- ### 5. Viral & Mouse Specificity Data
578
-
579
- #### gget virus - Viral Sequence Downloads
580
-
581
- Download viral nucleotide sequences plus linked metadata from INSDC sources via NCBI Virus, with optional GenBank metadata enrichment. Results are saved to an output folder as FASTA, CSV, JSONL, and a command summary file.
582
-
583
- **Parameters**:
584
- - `virus`: Virus taxon name, taxon ID, accession, space-separated accessions, or path to a text file of accessions
585
- - `-a/--is_accession`: Treat `virus` as accession input
586
- - `--is_sars_cov2`, `--is_alphainfluenza`: Use optimized cached NCBI datasets paths for SARS-CoV-2 or Influenza A
587
- - `--host`: Host organism name or NCBI taxonomy ID
588
- - `--nuc_completeness`: complete or partial
589
- - `--min_seq_length`, `--max_seq_length`: Sequence length filters
590
- - `-g/--genbank_metadata`: Fetch detailed GenBank metadata; auto-enabled by some annotation filters
591
- - `--segment`, `--vaccine_strain`, `--annotated`, `--lab_passaged`, `--source_database`: Common viral metadata filters
592
- - `--download_all_accessions`: Apply filters across all viral accessions
593
- - `--baseline`, `--merge-results`: Resume or merge with prior metadata from partial/previous runs
594
-
595
- **Important**: Do not use `--download_all_accessions` without restrictive filters; it can attempt to download the entire Viruses taxonomy and consume substantial time, bandwidth, and disk.
596
-
597
- **Examples**:
598
- ```bash
599
- # Complete Zika genomes from human hosts
600
- gget virus "Zika virus" --nuc_completeness complete --host human --out zika_data
601
-
602
- # SARS-CoV-2 reference genome by accession
603
- gget virus NC_045512.2 --is_accession --is_sars_cov2
604
- ```
605
-
606
- ```python
607
- # Python
608
- gget.virus(
609
- "SARS-CoV-2",
610
- host="human",
611
- nuc_completeness="complete",
612
- min_seq_length=29000,
613
- genbank_metadata=True,
614
- is_sars_cov2=True,
615
- outfolder="covid_data",
616
- )
617
- ```
618
-
619
- #### gget 8cube - Mouse Specificity & Expression
620
-
621
- Query 8cubeDB for snRNA-seq gene specificity metrics and normalized expression values across mouse strains, tissues, sexes, and individuals.
622
-
623
- **Subcommands**:
624
- - `gget 8cube specificity <genes...>`: Return gene-level psi/zeta specificity statistics
625
- - `gget 8cube psi_block <genes...> --analysis_level <level> --analysis_type <type>`: Return block-level specificity
626
- - `gget 8cube expression <genes...> --analysis_level <level> --analysis_type <type>`: Return mean/variance normalized expression
627
-
628
- **Examples**:
629
- ```bash
630
- gget 8cube specificity Acsm2 ENSMUSG00000046623.9
631
- gget 8cube psi_block Acsm2 --analysis_level Kidney --analysis_type "Sex:Celltype"
632
- gget 8cube expression Gjb4 --analysis_level Across_tissues --analysis_type Strain
633
- ```
634
-
635
- ```python
636
- # Python
637
- from gget import specificity, psi_block, gene_expression
638
-
639
- specificity(["Acsm2", "ENSMUSG00000046623.9"])
640
- psi_block(["Acsm2"], analysis_level="Kidney", analysis_type="Sex:Celltype")
641
- gene_expression(["Gjb4"], analysis_level="Across_tissues", analysis_type="Strain")
642
- ```
643
-
644
- ### 6. Additional Tools
645
-
646
- #### gget mutate - Generate Mutated Sequences
647
-
648
- Generate mutated nucleotide sequences from mutation annotations.
649
-
650
- **Current scope**: gget 0.29.1 simplified `mutate` to focus on applying standard mutation annotations to supplied nucleotide sequences and returning/saving mutated FASTA records. The broader variant-screening workflow moved upstream to the `kvar` project.
651
-
652
- **Parameters**:
653
- - `sequences`: FASTA file path or direct nucleotide sequence input (string/list)
654
- - `-m/--mutations`: Mutation string/list, CSV/TSV path, or DataFrame with mutation data (required)
655
- - `-mc/--mut_column`: Mutation column name (default: 'mutation')
656
- - `-sic/--seq_id_column`: Sequence ID column (default: 'seq_ID')
657
- - `-mic/--mut_id_column`: Mutation ID column (default: same as mut_column)
658
- - `-k/--k`: Length of flanking sequences (default: 30 nucleotides)
659
- - `-o/--out`: Output FASTA path; without it Python returns a list of mutated sequences
660
-
661
- **Returns**: Mutated sequences in FASTA format
662
-
663
- **Examples**:
664
- ```bash
665
- # Single mutation
666
- gget mutate ATCGCTAAGCT -m "c.4G>T"
667
-
668
- # Multiple sequences with one mutation per sequence
669
- gget mutate ATCGCTAAGCT TAGCTA -m "c.4G>T" "c.1_3inv" -o mutated.fasta
670
- ```
671
-
672
- ```python
673
- # Python
674
- gget.mutate("ATCGCTAAGCT", "c.4G>T")
675
- gget.mutate(["ATCGCTAAGCT", "TAGCTA"], ["c.4G>T", "c.1_3inv"], out="mutated.fasta")
676
- ```
677
-
678
- #### gget gpt - OpenAI Text Generation
679
-
680
- Generate natural language text using OpenAI's API.
681
-
682
- **Setup Required**:
683
- ```bash
684
- gget setup gpt
685
- ```
686
-
687
- **Important**: Requires an OpenAI API key. Do not hard-code the key in notebooks, scripts, shell history, or committed files. Prefer a named environment variable such as `OPENAI_API_KEY`, and set monthly billing limits before use.
688
-
689
- **Parameters**:
690
- - `prompt`: Text input for generation (required)
691
- - `api_key`: OpenAI authentication (required by the upstream API)
692
- - Model configuration: model, temperature, top_p, stop, max_tokens, frequency_penalty, presence_penalty, logit_bias
693
- - Default model: gpt-3.5-turbo (upstream default; verify available models in your OpenAI account)
694
-
695
- **Examples**:
696
- For CLI usage, `gget gpt` expects the API key as an argument. Avoid this on shared systems because process arguments can be visible to other users.
697
-
698
- ```python
699
- # Python
700
- import os
701
-
702
- gget.gpt("Explain CRISPR", api_key=os.environ["OPENAI_API_KEY"])
703
- ```
704
-
705
- #### gget setup - Install Dependencies
706
-
707
- Install/download third-party dependencies for specific modules.
708
-
709
- As of gget 0.29.2, `gget setup` tries `uv pip install` first for Python dependencies and falls back to plain `pip install` if uv is unavailable or fails.
710
-
711
- **Parameters**:
712
- - `module`: Module name requiring dependency installation
713
- - `-o/--out`: Output folder path (elm module only)
714
-
715
- **Modules requiring setup**:
716
- - `alphafold` - Downloads ~4GB of model parameters
717
- - `cellxgene` - Installs cellxgene-census (may require Python 3.9/3.10 if the latest Python is unsupported)
718
- - `elm` - Downloads local ELM database
719
- - `gpt` - Installs/configures OpenAI integration dependencies
720
-
721
- **Examples**:
722
- ```bash
723
- # Setup AlphaFold
724
- gget setup alphafold
725
-
726
- # Setup ELM with custom directory
727
- gget setup elm -o /path/to/elm_data
728
- ```
729
-
730
- ```python
731
- # Python
732
- gget.setup("alphafold")
733
- ```