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#478 Removed --bgc_antismash_installdir as new antiSMASH module container no longer requires mounting of this directory for execution. (by @mberacochea and @jfy133)
#435 Fixed dependency errors within taxonomy merging scripts, updated the code and output for all three workflows. Bumped to version 0.1.1. (by @Darcy220606)
#437 Fixed file name error when supplying already preprocessed CARD database for ARG workflow. (by @jasmezz)
#446 Updated antiSMASH modules to fix apptainer execution. (by @jasmezz and @jfy133)
#448 Fixed taxonomy merge to work with output from GTDB/SILVA/KALAMARI. (by @Darcy220606)
#447 Added --annotation_pyrodigal_usespecialstopcharacter parameter to improve AMPlify screening. (by @jasmezz)
#454 Updated default CPU requirement of ampcombi2/parsetables. (by @jasmezz)
#391 Made all "database" parameter names consistent, skip hmmsearch by default. (by @jasmezz)
Old parameter
New parameter
annotation_bakta_db_localpath
annotation_bakta_db
arg_abricate_db
arg_abricate_db_id
arg_abricate_localdbdir
arg_abricate_db
arg_deeparg_data
arg_deeparg_db
arg_deeparg_data_version
arg_deeparg_db_version
arg_rgi_database
arg_rgi_db
bgc_antismash_databases
bgc_antismash_db
bgc_antismash_installationdirectory
bgc_antismash_installdir
bgc_deepbgc_database
bgc_deepbgc_db
save_databases
save_db
taxa_classification_mmseqs_databases_localpath
taxa_classification_mmseqs_db
taxa_classification_mmseqs_databases_id
taxa_classification_mmseqs_db_id
taxa_classification_mmseqs_databases_savetmp
taxa_classification_mmseqs_db_savetmp
amp_skip_hmmsearch
amp_run_hmmsearch
bgc_skip_hmmsearch
bgc_run_hmmsearch
#343 Standardized the resulting workflow summary tables to always start with 'sample_id\tcontig_id\t..'. Reformatted the output of hamronization/summarize module. (by @Darcy220606)
#411 Optimised hAMRonization input: only high-quality hits from fARGene output are reported. (by @jasmezz, @jfy133)
Added
#322 Updated all modules: introduce environment.yml files. (by @jasmezz)
#324 Removed separate DeepARG test profile because database download is now stable. (by @jasmezz)
#358 Improved RGI databases handling, users can supply their own CARD now. (by @jasmezz)
#375 Merged pipeline template of nf-core/tools version 2.14.1. (by @jfy133)
#381 Added support for supplying pre-annotated sequences to the pipeline. (by @jfy133, @jasmezz)
#382 Optimised BGC screening run time and prevent crashes due to too-short contigs by adding contig length filtering for BGC workflow only. (by @jfy133, @Darcy220606)
#348 Updated samplesheet for pipeline tests to 'samplesheet_reduced.csv' with smaller datasets to reduce resource consumption. Updated prodigal module to fix pigz issue. Removed tests/ from .gitignore. (by @Darcy220606)
#362 Save annotations from bakta in subdirectories per sample. (by @jasmezz)
#363 Removed warning from DeepBGC usage docs. (by @jasmezz)
#365 Fixed AMRFinderPlus module and usage docs for manual database download. (by @jasmezz)
#386 Updated DeepBGC module to fix output file names, separate annotation step for all BGC tools, add warning if no BGCs found, fix MultiQC reporting of annotation workflow. (by @jfy133, @jasmezz)
#393 & #397 Fixed a docker/singularity only error appearing when running with conda. (❤️ to @ewissel for reporting, fix by @jfy33 & @jasmezz)
#391 Skip hmmmsearch by default to not crash pipeline if user provides no HMM files, updated docs. (by @jasmezz)
#397 Removed deprecated AMPcombi module, fixed variable name in BGC workflow, updated minor parts in docs (usage, parameter schema). (by @jasmezz)
#402 Fixed BGC length calculation for antiSMASH hits by comBGC. (by @jasmezz)
#406 Fixed prediction tools not being executed if annotation workflow skipped. (by @jasmezz)
#409 Fixed argNorm overwriting its output for DeepARG. (by @jasmezz, @jfy133)
#412 Improve all pre-run database download documentation. (by @jfy133)
Dependencies
Tool
Previous version
New version
AMPcombi
0.1.7
0.2.2
AMPlify
1.1.0
2.0.0
AMRFinderPlus
3.11.18
3.12.8
antiSMASH
6.1.1
7.1.0
argNorm
NA
0.5.0
bioawk
1.0
NA
comBGC
1.6.1
1.6.2
DeepARG
1.0.2
1.0.4
DeepBGC
0.1.30
0.1.31
GECCO
0.9.8
0.9.10
hAMRonization
1.1.1
1.1.4
HMMER
3.3.2
3.4
MMSeqs
NA
2:15.6f452
MultiQC
1.15
1.24
Pyrodigal
2.1.0
3.3.0
RGI
5.2.1
6.0.3
seqkit
NA
2.8.1
tabix/htslib
1.11
1.20
Deprecated
#384 Deprecated AMPcombi and exchanged it with full suite of AMPcombi2 submodules. (by @Darcy220606)
#382 Optimised BGC screening run time and prevent crashes due to too-short contigs by adding contig length filtering for BGC workflow only. Bioawk is replaced with seqkit. (by @jfy133, @Darcy220606)
#270 Merged pipeline template of nf-core/tools version 2.8 and updated modules accordingly. (by @jasmezz, @jfy133)
#274 Update all modules: changed docker links according to the change of quay.io as default repository and Pyrodigal annotation output now zipped. (by @jasmezz)
#275 Save DRAMP database in the common database directory if --save_databases is supplied. (by @jasmezz)
Fixed
#272 Fix typo in Prokka output path in modules.config. (by @jasmezz)
#238 Added dedicated DRAMP database downloading step for AMPcombi to prevent parallel downloads when no database provided by user. (by @jfy133)
#235 Added parameter annotation_bakta_db_downloadtype to be able to switch between downloading either full (33.1 GB) or light (1.3 GB excluding UPS, IPS, PSC, see parameter description) versions of the Bakta database. (by @jasmezz)
#249 Added bakta annotation to CI tests. (by @jasmezz)
#252 Added a new parameter -arg_rgi_savejson that saves the file <samplename>.json in the RGI directory. The default ouput for RGI is now only <samplename>.txt. (by @Darcy220606)
#253 Updated Prodigal to have compressed output files. (by @jasmezz)
#262 Added comBGC function to screen whole directory of antiSMASH output (one subfolder per sample). (by @jasmezz)
#263 Removed AMPlify from test_full.config. (by @jasmezz)
#266 Updated README.md with Pyrodigal. (by @jasmezz)
Fixed
#243 Compress the ampcombi_complete_summary.csv in the output directory. (by @louperelo)
#237 Reactivate DeepARG automatic database downloading and CI tests as server is now back up. (by @jfy133)
#235 Improved annotation speed by switching off pipeline-irrelevant Bakta annotation steps by default. (by @jasmezz)
#235 Renamed parameter annotation_bakta_db to annotation_bakta_db_localpath. (by @jasmezz)
#242 Fixed MACREL '.faa' issue that was generated when it was run on its own and upgraded MACREL from version 1.1.0 to 1.2.0 (by @Darcy220606)
#248 Applied best-practice error("message") to all (sub)workflow files. (by @jasmezz)
#254 Further resource optimisation based on feedback from 'real world' datasets. (ongoing, reported by @alexhbnr and @Darcy220606, fix by @jfy133)