ContainersNVIDIADeepSeek-R1NVIDIALlama-3.1-Nemotron-70B-InstructNVIDIAPyTorch
CollectionsNVIDIAOmniverse Kit (FB)NVIDIADeepStream SDKNVIDIAOmniverse Kit App Streaming
ModelsNVIDIAStyleGAN3 pretrained modelsNVIDIAPeopleNetNVIDIATrafficCamNet
ResourcesNVIDIARiva Skills Quick Start
Helm ChartsNVIDIAGPU OperatorNVIDIANVIDIA NIM Operator
UIUC
vmd
Container
UIUC
vmd

VMD is designed for modeling, visualization, and analysis of biomolecular systems such as proteins, nucleic acids, lipid membranes, carbohydrate structures, etc. VMD provides a wide variety of graphical representations for visualizing and coloring molecular structures: molecular surfaces, space-filling CPK spheres and cylinders, licorice bonds, backbone tubes and ribbons, secondary structure cartoons, and others.

LayerLabelCreated
sha256:bc0f9547f0671eb0a14c34446704dacc88b401b971f5db6f62228e30226f98eaRUN
cd tmp &&
  tar --no-same-owner -xf /tmp/NAMD_3.0alpha3_Linux-ARM64-multicore-CUDA-SingleNode.tar.gz &&
  mkdir -p /usr/local/bin &&
  cd NAMD_3* &&
  cp namd3 charmrun flipbinpdb flipdcd psfgen sortreplicas /usr/local/bin &&
  cd ../.. &&
  rm -rf /tmp/NAMD_3*
06/25/2020 8:56 PM UTC
sha256:06f438b790cb60236f916ae246e6fb016038dfed1d72c2448937f5f366703ac0COPY
file:cf79743962ed4a26990d89d741105a5a330e57aafe1640cb31ed3645b99c8370 in /tmp/
06/25/2020 8:56 PM UTC
sha256:ffd302068e8681a7afc6638c5c5fbcdef985dd2e22396619c6dde9d30cf719a5RUN
export LD_LIBRARY_PATH=/usr/local/lib/vmd:$LD_LIBRARY_PATH &&
  ldconfig
06/25/2020 8:56 PM UTC
sha256:8f41b17d024de5f2ee50dafbc7cc0e8d79977c32df3ebef1c44708f120284b9dRUN
cd tmp &&
  tar --no-same-owner -xf vmd-1.9.4a44.bin.LINUXARM64.egl.tar.gz &&
  cd vmd-1.9.4a44 &&
  ./configure &&
  cd src &&
  make install &&
  cd ../.. &&
  rm -rf /tmp/vmd-1.9.4*
06/25/2020 8:56 PM UTC
sha256:4b0ecffd0a901f0f4d14439264790115ab84e6bc91a2c8df32790429bc1d5f1fCOPY
file:9dd0b8eb74b8b1fa37e1d44b6fc4ae7cd817bf9842c649d142667cdfa12e7f5f in /tmp/
06/25/2020 8:56 PM UTC
sha256:53c0d1686fd173ea2e446622f903529b9d4bddce8d58feb8191172a22ce35421RUN
rm -f /usr/share/glvnd/egl_vendor.d/50_mesa.json
06/25/2020 8:56 PM UTC
sha256:a98e6a32edf804393471cf0647ed8ae534d9c3f0c3cc2e9d3ee3654bcef52d9cRUN
apt-get update &&
  apt-get install -y --no-install-recommends vim make csh wget &&
  rm -rf /var/lib/apt/lists/*
06/25/2020 8:56 PM UTC
sha256:b95467d489847bf220237a6ce9d5bc550043167b565b347f96b60959ab916b50RUN
ldconfig
06/25/2020 8:55 PM UTC
sha256:4a319ebef75dc55f7f54f5d457a624954d6262eb8421ad3ba0cd3f3ce298c1c2COPY
file:7f099b83994b42206e25be3e2fbcdc426ad3ab9c1a1081825740f5566d02557d in /usr/share/glvnd/egl_vendor.d/
06/25/2020 8:55 PM UTC
sha256:15e0a7c8366be08d50a1e9641d411e937aef34ff054dc7b923fa9966d705e729RUN
apt-get update -y &&
  DEBIAN_FRONTEND=noninteractive apt-get install -y --no-install-recommends freeglut3 libegl1 libgl1 libglvnd0 libopengl0 &&
  rm -rf /var/lib/apt/lists/*
06/25/2020 8:55 PM UTC

NVIDIA uses cookies to improve your experience on our web site. We and our third-party partners also use cookies and other tools to collect and record information you provide as well as information about your interactions with our websites for performance improvement, analytics, and to assist in marketing efforts. By clicking "Accept All", you consent to our use of cookies and other tools as described in our Cookie Policy. You can manage your cookie settings by clicking on "Manage Settings." By continuing to use this site or by clicking one of the buttons below, you agree to our Terms of Service (which contains important waivers). Please see our Privacy Policy for more information on our privacy practices.