Transmission3d is a 3-dimensional, multi-body gear contact analysis software capable of modeling complex gear systems developed by Ansol (Advanced Numeric Solutions). Multiple gear types, including: Helical, Straight Bevel, Spiral Bevel, Hypoids, Beveloids and Worms can be modeled. Multiple bearing types, as well as complex shafts, carriers and housings can also be modeled with the software. A variety of output data options including tooth bending stress, contact patterns, and displacement are also available.
The Natural Bond Orbital (NBO) program is a discovery tool for chemical insights from complex wavefunctions.
Rosetta is a software suite that includes algorithms for computational modeling and analysis of protein structures.
Desmond is a software package that perform high-speed molecular dynamics simulations of biological systems on conventional commodity clusters, general-purpose supercomputers, and GPUs.
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Here are the queues available on Pitzer. Please note that you will be routed to the appropriate queue based on your walltime and job size request.
Replace MV2_ENABLE_AFFINITY=0 with MV2_CPU_BINDING_POLICY=hybrid.