datagrok/demo_db_chembl:12.9-rdkit2022032-32

Index digest

sha256:81c7f5fcf8f4ca0045241b3280eefc7be9eb2efddfdd056151591864fc5aacbc

OS/ARCH

linux/amd64

Compressed size

5.73 GB

Last pushed

over 3 years by spodgrok

Type

Image

Manifest digest

sha256:900059f18c0bfdbfebe6c8b6802959ed00b93a22f5b935cde083fc8d53ab59ee

Image Layers

Image Layers

1ADD file ... in / 29.95 MB

2CMD ["bash"]0 B

3/bin/sh -c set -eux; groupadd1.76 KB

4/bin/sh -c set -ex; apt-get4.21 MB

5ENV GOSU_VERSION=1.160 B

6/bin/sh -c set -eux; savedAptMark="$(apt-mark1.4 MB

7/bin/sh -c set -eux; if7.67 MB

8ENV LANG=en_US.utf80 B

9/bin/sh -c set -eux; apt-get1.2 MB

10/bin/sh -c mkdir /docker-entrypoint-initdb.d147 B

11/bin/sh -c set -ex; key='B97B0AFCAA1A47F044F244A07FCC7D46ACCC4CF8';3.13 KB

12ENV PG_MAJOR=120 B

13ENV PATH=/usr/local/sbin:/usr/local/bin:/usr/sbin:/usr/bin:/sbin:/bin:/usr/lib/postgresql/12/bin0 B

14ENV PG_VERSION=12.14-1.pgdg110+10 B

15/bin/sh -c set -ex; export85.5 MB

16/bin/sh -c set -eux; dpkg-divert8.81 KB

17/bin/sh -c mkdir -p /var/run/postgresql129 B

18ENV PGDATA=/var/lib/postgresql/data0 B

19/bin/sh -c mkdir -p "$PGDATA"198 B

20VOLUME [/var/lib/postgresql/data]0 B

21COPY file:512acb0aab31f9e5d908f16e2f4478f65cddd5d4e555a02a1551074bb16f54d7 in /usr/local/bin/ 4.67 KB

22ENTRYPOINT ["docker-entrypoint.sh"]0 B

23STOPSIGNAL SIGINT0 B

24EXPOSE 54320 B

25CMD ["postgres"]0 B

26RUN /bin/sh -c set -ex2.36 MB

27ENV PATH=/venv/bin:/usr/local/sbin:/usr/local/bin:/usr/sbin:/usr/bin:/sbin:/bin:/usr/lib/postgresql/12/bin0 B

28COPY /usr/local/include/boost/ /usr/local/include/boost/ # buildkit13.96 MB

29COPY /usr/local/lib/ /usr/local/lib/ # buildkit12.48 MB

30COPY /usr/lib/cmake/rdkit /usr/lib/cmake/rdkit # buildkit10.97 KB

31COPY /etc/python3.8/ /etc/python3.8/ # buildkit272 B

32COPY /usr/bin/python3.8 /usr/bin/python3.8 # buildkit2.42 MB

33COPY /usr/bin/pydoc3.8 /usr/bin/pydoc3.8 # buildkit222 B

34COPY /usr/bin/pygettext3.8 /usr/bin/pygettext3.8 # buildkit7.1 KB

35COPY /usr/bin/pdb3.8 /usr/bin/pdb3.8 # buildkit16.97 KB

36COPY /usr/bin/python3.8-config /usr/bin/python3.8-config # buildkit1.36 KB

37COPY /usr/bin/x86_64-linux-gnu-python3.8-config /usr/bin/x86_64-linux-gnu-python3.8-config # buildkit1.36 KB

38COPY /usr/lib/python3.8/ /usr/lib/python3.8/ # buildkit19.1 MB

39COPY /usr/lib/python3/ /usr/lib/python3/ # buildkit1.77 MB

40COPY /usr/lib/x86_64-linux-gnu/libpython3.8.so.1.0 /usr/lib/x86_64-linux-gnu/libpython3.8.so.1.0 # buildkit2.1 MB

41COPY /usr/lib/x86_64-linux-gnu/libpython3.8.so.1 /usr/lib/x86_64-linux-gnu/libpython3.8.so.1 # buildkit2.1 MB

42COPY /usr/lib/x86_64-linux-gnu/libpython3.8.a /usr/lib/x86_64-linux-gnu/libpython3.8.a # buildkit2.87 MB

43COPY /usr/lib/x86_64-linux-gnu/libpython3.8.so /usr/lib/x86_64-linux-gnu/libpython3.8.so # buildkit2.1 MB

44COPY /usr/include/x86_64-linux-gnu/python3.8/ /usr/include/x86_64-linux-gnu/python3.8/ # buildkit10.24 KB

45COPY /usr/include/python3.8/ /usr/include/python3.8/ # buildkit162.63 KB

46COPY /venv /venv # buildkit29.29 MB

47COPY /usr/lib/libRDKit* /usr/lib/ # buildkit38.96 MB

48COPY /usr/lib/cmake/rdkit /usr/lib/cmake/rdkit # buildkit32 B

49COPY /usr/share/RDKit/ /usr/share/RDKit/ # buildkit32.19 MB

50COPY /usr/include/rdkit/ /usr/include/rdkit/ # buildkit348.32 KB

51COPY /rdkit/build/Code/PgSQL/rdkit/rdkit--4.2.0.sql /usr/share/postgresql/12/extension/rdkit--4.2.0.sql # buildkit5.13 KB

52COPY /rdkit/Code/PgSQL/rdkit/rdkit.control /usr/share/postgresql/12/extension/rdkit.control # buildkit340 B

53COPY /rdkit/build/Code/PgSQL/rdkit/librdkit.so /usr/lib/postgresql/12/lib/rdkit.so # buildkit3.7 MB

54ENV POSTGRES_USER=datagrok0 B

55ENV POSTGRES_PASSWORD=datagrok0 B

56ARG POSTGRES_DB=chembl0 B

57ENV POSTGRES_DB=chembl0 B

58ENV PGPASSWORD=datagrok0 B

59ENV PGUSER=datagrok0 B

60VOLUME [/var/lib/postgresql/data]0 B

61USER postgres0 B

62RUN |1 POSTGRES_DB=chembl /bin/sh -c4.25 GB

63ARG DUMP_SOURCE_DIR=./src0 B

64COPY ./src/rdkit.sql /docker-entrypoint-initdb.d/rdkit.sql # buildkit581 B

65COPY ./src/healthcheck.sh /docker-healthcheck.sh # buildkit546 B

66RUN |2 POSTGRES_DB=chembl DUMP_SOURCE_DIR=./src /bin/sh1.19 GB

67USER root0 B

68RUN |2 POSTGRES_DB=chembl DUMP_SOURCE_DIR=./src /bin/sh1.99 KB

69HEALTHCHECK &{["CMD" "/docker-healthcheck.sh"] "0s" "0s"0 B

Command

ADD file:a2378c1b12e95db69e24b9d347441678c6f23239292cce3c822b1524992b6ec4 in /