ISyMAB

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Contents

General Information

  • Application's name : Integrated System for Modeling and data Analysis of complex Biomolecules
  • Virtual Research Communities : Computational Chemistry Applications
  • Scientific contact : Ionut Traian Vasile, itvasile@nipne.ro
  • Technical contact : Ionut Traian Vasile, itvasile@nipne.ro
  • Developers : Ionut Traian Vasile, IFIN-HH, Department of Elementary Particles and Informational Technologies, Romania
  • Web site :

Application and Short Description

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Problems Solved

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Scientific and Social Impact

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Collaborations and Beneficiaries

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Technical features and HP-SEE implementation

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Usage Example

  • Primary programming language : Tobefilledin
  • Parallel programming paradigm : Tobefilledin
  • Main parallel code : Tobefilledin
  • Pre/post processing code : Tobefilledin
  • Application tools and libraries : Enumerate (comma separated)
  • Number of cores required : Tobefilledin
  • Minimum RAM/core required : Tobefilledin
  • Storage space during a single run : Tobefilledin
  • Long-term data storage : Tobefilledin

Publications and Presentations

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