Nvidia
NVIDIA NIM for GenMol
Container
Nvidia
NVIDIA NIM for GenMol

GenMol is a masked diffusion model trained on molecular SAFE representations for fragment-based molecule generation, which can serve as a generalist model for various drug discovery tasks.

  • LayerLabelCreated
    sha256:a3ed95caeb02ffe68cdd9fd84406680ae93d633cb16422d00e8a7c22955b46d4ENTRYPOINT
    ["/bin/bash" "-c" "$SERVER_START_SCRIPT_PATH"]
    08/07/2025 8:05 AM UTC
    sha256:06c2f2ab77b172183730556d9a27ca1f838548a0e019a67bce6220fa61ea4e4cRUN
    RUN /bin/sh -c touch $SERVER_START_SCRIPT_PATH &&
      chmod a+rx $SERVER_START_SCRIPT_PATH &&
      cat > $SERVER_START_SCRIPT_PATH <<-EOF #!/usr/bin/env bash set -eu # SPDX-FileCopyrightText: Copyright (c) 2024 NVIDIA CORPORATION & AFFILIATES. All rights reserved. # SPDX-License-Identifier: LicenseRef-NvidiaProprietary start_server EOF # buildkit
    08/07/2025 8:05 AM UTC
    sha256:a3ed95caeb02ffe68cdd9fd84406680ae93d633cb16422d00e8a7c22955b46d4ENV
    SERVER_START_SCRIPT_PATH=/opt/nim/start_server.sh
    08/07/2025 8:05 AM UTC
    sha256:e77207947a84bb70a721e504c9ea271ac64ffa346f5b0ef3203fe259e61a875eCOPY
    model_manifest.yaml /opt/nim/etc/default/model_manifest.yaml
    08/07/2025 8:05 AM UTC
    sha256:a3ed95caeb02ffe68cdd9fd84406680ae93d633cb16422d00e8a7c22955b46d4USER
    nvs:1000
    08/07/2025 8:05 AM UTC
    sha256:dac00bae16d1eab91fea220b6adb882fbb2aae47b1d0ea9df98152d82babb7faRUN
    groupadd --gid 1000 --non-unique nvs &&
      useradd --create-home --shell /usr/sbin/nologin --uid 1000 --non-unique --gid 1000 nvs &&
      chown 1000.1000 $NIM_DIR_PATH
    08/07/2025 8:05 AM UTC
    sha256:5ceb3db6bd4c2c677a46ae063331af8700f1b056c1bb2741e0019ed50a693e5cCOPY
    ./LICENSE ./VERSION /opt/nim
    08/07/2025 8:05 AM UTC
    sha256:1ffd20dd2f45f2595dee720a5dafd54258ea610268af2f3d6d29be7899c0f8eeCOPY
    ./inference.py /opt/nim
    08/07/2025 8:05 AM UTC
    sha256:40590795224e17615a375446f6b083bdc1881868349d1b24dfe9526449b7382fCOPY
    ./data_models.py /opt/nim
    08/07/2025 8:05 AM UTC
    sha256:44cc7fa1b121e97269b8e0c273e3b11d0d4e6af16a32ec70e48e36d19ebb2779COPY
    --chmod=755 Third_party_attr.txt /opt/nim/
    08/07/2025 8:05 AM UTC
    ...