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Add export to RDKIT to allow for chemdraw style visualization. #1056

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Triggered via pull request October 19, 2023 00:06

synchronize #1137

chrisiacovella:rdkit_vis

Status Failure

Total duration 14m 36s

Artifacts –

CI.yaml

on: pull_request

Matrix: mBuild Tests

Bleeding Edge mosdef Tests for mBuild

Build Docker Image

Annotations

10 errors and 20 warnings

Bleeding Edge mosdef Tests for mBuild

Process completed with exit code 1.

mBuild Tests (ubuntu-latest, 3.11)

Process completed with exit code 1.

mBuild Tests (ubuntu-latest, 3.9)

Process completed with exit code 1.

mBuild Tests (macOS-latest, 3.11)

Process completed with exit code 1.

mBuild Tests (ubuntu-latest, 3.10)

Process completed with exit code 1.

mBuild Tests (macOS-latest, 3.10)

Process completed with exit code 1.

mBuild Tests (windows-latest, 3.10)

Process completed with exit code 1.

mBuild Tests (windows-latest, 3.9)

Process completed with exit code 1.

mBuild Tests (windows-latest, 3.11)

Process completed with exit code 1.

mBuild Tests (macOS-latest, 3.9)

Process completed with exit code 1.

Bleeding Edge mosdef Tests for mBuild

Unexpected input(s) 'python-version', valid inputs are ['condarc-file', 'condarc', 'environment-file', 'environment-name', 'create-args', 'log-level', 'micromamba-version', 'micromamba-url', 'init-shell', 'generate-run-shell', 'cache-downloads', 'cache-downloads-key', 'cache-environment', 'cache-environment-key', 'post-cleanup', 'micromamba-root-path', 'micromamba-binary-path']

Bleeding Edge mosdef Tests for mBuild

Unexpected input(s) 'python-version', valid inputs are ['condarc-file', 'condarc', 'environment-file', 'environment-name', 'create-args', 'log-level', 'micromamba-version', 'micromamba-url', 'init-shell', 'generate-run-shell', 'cache-downloads', 'cache-downloads-key', 'cache-environment', 'cache-environment-key', 'post-cleanup', 'micromamba-root-path', 'micromamba-binary-path']

mBuild Tests (ubuntu-latest, 3.11)

Unexpected input(s) 'python-version', valid inputs are ['condarc-file', 'condarc', 'environment-file', 'environment-name', 'create-args', 'log-level', 'micromamba-version', 'micromamba-url', 'init-shell', 'generate-run-shell', 'cache-downloads', 'cache-downloads-key', 'cache-environment', 'cache-environment-key', 'post-cleanup', 'micromamba-root-path', 'micromamba-binary-path']

mBuild Tests (ubuntu-latest, 3.11)

Unexpected input(s) 'python-version', valid inputs are ['condarc-file', 'condarc', 'environment-file', 'environment-name', 'create-args', 'log-level', 'micromamba-version', 'micromamba-url', 'init-shell', 'generate-run-shell', 'cache-downloads', 'cache-downloads-key', 'cache-environment', 'cache-environment-key', 'post-cleanup', 'micromamba-root-path', 'micromamba-binary-path']

mBuild Tests (ubuntu-latest, 3.9)

Unexpected input(s) 'python-version', valid inputs are ['condarc-file', 'condarc', 'environment-file', 'environment-name', 'create-args', 'log-level', 'micromamba-version', 'micromamba-url', 'init-shell', 'generate-run-shell', 'cache-downloads', 'cache-downloads-key', 'cache-environment', 'cache-environment-key', 'post-cleanup', 'micromamba-root-path', 'micromamba-binary-path']

mBuild Tests (ubuntu-latest, 3.9)

Unexpected input(s) 'python-version', valid inputs are ['condarc-file', 'condarc', 'environment-file', 'environment-name', 'create-args', 'log-level', 'micromamba-version', 'micromamba-url', 'init-shell', 'generate-run-shell', 'cache-downloads', 'cache-downloads-key', 'cache-environment', 'cache-environment-key', 'post-cleanup', 'micromamba-root-path', 'micromamba-binary-path']

mBuild Tests (macOS-latest, 3.11)

Unexpected input(s) 'python-version', valid inputs are ['condarc-file', 'condarc', 'environment-file', 'environment-name', 'create-args', 'log-level', 'micromamba-version', 'micromamba-url', 'init-shell', 'generate-run-shell', 'cache-downloads', 'cache-downloads-key', 'cache-environment', 'cache-environment-key', 'post-cleanup', 'micromamba-root-path', 'micromamba-binary-path']

mBuild Tests (macOS-latest, 3.11)

Unexpected input(s) 'python-version', valid inputs are ['condarc-file', 'condarc', 'environment-file', 'environment-name', 'create-args', 'log-level', 'micromamba-version', 'micromamba-url', 'init-shell', 'generate-run-shell', 'cache-downloads', 'cache-downloads-key', 'cache-environment', 'cache-environment-key', 'post-cleanup', 'micromamba-root-path', 'micromamba-binary-path']

mBuild Tests (ubuntu-latest, 3.10)

Unexpected input(s) 'python-version', valid inputs are ['condarc-file', 'condarc', 'environment-file', 'environment-name', 'create-args', 'log-level', 'micromamba-version', 'micromamba-url', 'init-shell', 'generate-run-shell', 'cache-downloads', 'cache-downloads-key', 'cache-environment', 'cache-environment-key', 'post-cleanup', 'micromamba-root-path', 'micromamba-binary-path']

mBuild Tests (ubuntu-latest, 3.10)

Unexpected input(s) 'python-version', valid inputs are ['condarc-file', 'condarc', 'environment-file', 'environment-name', 'create-args', 'log-level', 'micromamba-version', 'micromamba-url', 'init-shell', 'generate-run-shell', 'cache-downloads', 'cache-downloads-key', 'cache-environment', 'cache-environment-key', 'post-cleanup', 'micromamba-root-path', 'micromamba-binary-path']

mBuild Tests (macOS-latest, 3.10)

Unexpected input(s) 'python-version', valid inputs are ['condarc-file', 'condarc', 'environment-file', 'environment-name', 'create-args', 'log-level', 'micromamba-version', 'micromamba-url', 'init-shell', 'generate-run-shell', 'cache-downloads', 'cache-downloads-key', 'cache-environment', 'cache-environment-key', 'post-cleanup', 'micromamba-root-path', 'micromamba-binary-path']

mBuild Tests (macOS-latest, 3.10)

Unexpected input(s) 'python-version', valid inputs are ['condarc-file', 'condarc', 'environment-file', 'environment-name', 'create-args', 'log-level', 'micromamba-version', 'micromamba-url', 'init-shell', 'generate-run-shell', 'cache-downloads', 'cache-downloads-key', 'cache-environment', 'cache-environment-key', 'post-cleanup', 'micromamba-root-path', 'micromamba-binary-path']

mBuild Tests (windows-latest, 3.10)

Unexpected input(s) 'python-version', valid inputs are ['condarc-file', 'condarc', 'environment-file', 'environment-name', 'create-args', 'log-level', 'micromamba-version', 'micromamba-url', 'init-shell', 'generate-run-shell', 'cache-downloads', 'cache-downloads-key', 'cache-environment', 'cache-environment-key', 'post-cleanup', 'micromamba-root-path', 'micromamba-binary-path']

mBuild Tests (windows-latest, 3.10)

Unexpected input(s) 'python-version', valid inputs are ['condarc-file', 'condarc', 'environment-file', 'environment-name', 'create-args', 'log-level', 'micromamba-version', 'micromamba-url', 'init-shell', 'generate-run-shell', 'cache-downloads', 'cache-downloads-key', 'cache-environment', 'cache-environment-key', 'post-cleanup', 'micromamba-root-path', 'micromamba-binary-path']

mBuild Tests (windows-latest, 3.9)

Unexpected input(s) 'python-version', valid inputs are ['condarc-file', 'condarc', 'environment-file', 'environment-name', 'create-args', 'log-level', 'micromamba-version', 'micromamba-url', 'init-shell', 'generate-run-shell', 'cache-downloads', 'cache-downloads-key', 'cache-environment', 'cache-environment-key', 'post-cleanup', 'micromamba-root-path', 'micromamba-binary-path']

mBuild Tests (windows-latest, 3.9)

Unexpected input(s) 'python-version', valid inputs are ['condarc-file', 'condarc', 'environment-file', 'environment-name', 'create-args', 'log-level', 'micromamba-version', 'micromamba-url', 'init-shell', 'generate-run-shell', 'cache-downloads', 'cache-downloads-key', 'cache-environment', 'cache-environment-key', 'post-cleanup', 'micromamba-root-path', 'micromamba-binary-path']

mBuild Tests (windows-latest, 3.11)

Unexpected input(s) 'python-version', valid inputs are ['condarc-file', 'condarc', 'environment-file', 'environment-name', 'create-args', 'log-level', 'micromamba-version', 'micromamba-url', 'init-shell', 'generate-run-shell', 'cache-downloads', 'cache-downloads-key', 'cache-environment', 'cache-environment-key', 'post-cleanup', 'micromamba-root-path', 'micromamba-binary-path']

mBuild Tests (windows-latest, 3.11)

Unexpected input(s) 'python-version', valid inputs are ['condarc-file', 'condarc', 'environment-file', 'environment-name', 'create-args', 'log-level', 'micromamba-version', 'micromamba-url', 'init-shell', 'generate-run-shell', 'cache-downloads', 'cache-downloads-key', 'cache-environment', 'cache-environment-key', 'post-cleanup', 'micromamba-root-path', 'micromamba-binary-path']

mBuild Tests (macOS-latest, 3.9)

Unexpected input(s) 'python-version', valid inputs are ['condarc-file', 'condarc', 'environment-file', 'environment-name', 'create-args', 'log-level', 'micromamba-version', 'micromamba-url', 'init-shell', 'generate-run-shell', 'cache-downloads', 'cache-downloads-key', 'cache-environment', 'cache-environment-key', 'post-cleanup', 'micromamba-root-path', 'micromamba-binary-path']

mBuild Tests (macOS-latest, 3.9)

Unexpected input(s) 'python-version', valid inputs are ['condarc-file', 'condarc', 'environment-file', 'environment-name', 'create-args', 'log-level', 'micromamba-version', 'micromamba-url', 'init-shell', 'generate-run-shell', 'cache-downloads', 'cache-downloads-key', 'cache-environment', 'cache-environment-key', 'post-cleanup', 'micromamba-root-path', 'micromamba-binary-path']