Updated to latest ModelCIF dict verion

validation/Dockerfile

@@ -80,7 +80,7 @@ COPY --chmod=755 validate-mmcif-file.py /usr/local/bin/validate-mmcif-file
 ## https://github.com/ihmwg/ModelCIF/blob/master/dist/mmcif_ma.dic.
 ## Dictionaries do not change that frequently therefore we skip the hassle of
 ## keeping them in an external volume.
-ARG USE_DICT_VERSION="1.4.5"
+ARG USE_DICT_VERSION="1.4.6"
 ENV USE_DICT_VERSION=${USE_DICT_VERSION}
 LABEL org.modelarchive.dict_release="${USE_DICT_VERSION}"
 WORKDIR ${SRC_DIR}
@@ -91,7 +91,7 @@ RUN set -e pipefail; \
     export _GIT_URL="https://raw.github.com/ihmwg/ModelCIF/master"; \
     # Use the path of an actual commit to keep the dict immutable (RCSB refuses
     # to use Git tags for versions).
-    export _MA_DICT_URL="https://raw.githubusercontent.com/ihmwg/ModelCIF/ba728c4/archive/mmcif_ma-v${USE_DICT_VERSION}.dic"; \
+    export _MA_DICT_URL="https://raw.githubusercontent.com/ihmwg/ModelCIF/d18ba38/archive/mmcif_ma-v${USE_DICT_VERSION}.dic"; \
     mkdir ${_DICT_DIR}; \
     mkdir ${MMCIF_DICTS_DIR}; \
     cd ${_DICT_DIR}; \
@@ -117,11 +117,15 @@ RUN set -e pipefail; \
     ## Build the PDBx/mmCIF SDB
     DictToSdb -ddlFile mmcif_ddl.dic \
               -dictFile mmcif_pdbx_v50.dic \
-              -dictSdbFile ${MMCIF_DICTS_DIR}/mmcif_pdbx_v50.dic.sdb; \
+              -dictSdbFile ${MMCIF_DICTS_DIR}/mmcif_pdbx_v50.sdb; \
     #
     ## Get versions of ModelCIF & PDBx/mmCIF dictionaries
     get-mmcif-dict-versions --child-location ${_MA_DICT_URL} mmcif_ma.dic; \
     mv mmcif_ma_version.json ${MMCIF_DICTS_DIR}/; \
+    get-mmcif-dict-versions --child-location ${_DICT_URL}/mmcif_pdbx_v50.dic \
+                            --output mmcif_pdbx_v50_version.json \
+                            mmcif_pdbx_v50.dic; \
+    mv mmcif_pdbx_v50_version.json ${MMCIF_DICTS_DIR}/; \
     #
     ## Make SDBs readable and keep possible error logs from building them
     mv *.log ${MMCIF_DICTS_DIR}/ 2>/dev/null || :; \

validation/README.md

@@ -93,7 +93,7 @@ $
 
 **`--help`** (**`-h`**) Print a help/ usage page for the validation tool.
 
-**`--dict-sdb <SDB FILE>`** (**`-d`**) Format dictionary in (binary) SDB format used for validating a ModelCIF file. The Docker container comes with a SDB for ModelCIF (`/usr/local/share/mmcif-dict-suite/mmcif_ma.sdb`) and one for the original PDBx/mmCIF (`/usr/local/share/mmcif-dict-suite/mmcif_pdbx_v50.dic.sdb`) format.
+**`--dict-sdb <SDB FILE>`** (**`-d`**) Format dictionary in (binary) SDB format used for validating a ModelCIF file. The Docker container comes with a SDB for ModelCIF (`/usr/local/share/mmcif-dict-suite/mmcif_ma.sdb`) and one for the original PDBx/mmCIF (`/usr/local/share/mmcif-dict-suite/mmcif_pdbx_v50.sdb`) format.
 
 **`--out-file <JSON FILE>`** (**`-o`**) Instead of printing the output to `stdout`, store it in a JSON formatted file.