TY - GEN N2 - When filming a movie, capturing the essence of a story goes beyond still shots of key scenes. Imagine trying to understand the plot of a movie by only looking at a single frame of the opening scene and another of the closing scene. To appreciate the story, you need the whole film reel, complete with scenes, dialogue, and the actions that bring the story to life. Molecular dynamics simulations are like "movies" of biomolecular systems, allowing scientists to watch complex dynamics with atomic-level detail. In this work, we address the unique challenges that creating and analyzing these movies presents. DO - 10.6083/jd472x26t DO - DOI AB - When filming a movie, capturing the essence of a story goes beyond still shots of key scenes. Imagine trying to understand the plot of a movie by only looking at a single frame of the opening scene and another of the closing scene. To appreciate the story, you need the whole film reel, complete with scenes, dialogue, and the actions that bring the story to life. Molecular dynamics simulations are like "movies" of biomolecular systems, allowing scientists to watch complex dynamics with atomic-level detail. In this work, we address the unique challenges that creating and analyzing these movies presents. T1 - Doing more with less: improved simulation and analysis of biomolecular systems DA - 2023 AU - Russo, John D. L1 - https://digitalcollections.ohsu.edu/record/10142/files/Russo.John.2023.pdf PB - Oregon Health and Science University PY - 2023 ID - 10142 L4 - https://digitalcollections.ohsu.edu/record/10142/files/Russo.John.2023.pdf KW - Algorithms KW - Molecular Dynamics Simulation TI - Doing more with less: improved simulation and analysis of biomolecular systems Y1 - 2023 L2 - https://digitalcollections.ohsu.edu/record/10142/files/Russo.John.2023.pdf LK - https://digitalcollections.ohsu.edu/record/10142/files/Russo.John.2023.pdf UR - https://digitalcollections.ohsu.edu/record/10142/files/Russo.John.2023.pdf ER -