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PetaChemQuantum Chemistry on GPUs with NVIDIA CUDA
http://www.petachem.com/
Quantum Chemistry on GPUs with NVIDIA CUDA
http://www.petachem.com/
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PetaChem | petachem.com Reviews
https://petachem.com
Quantum Chemistry on GPUs with NVIDIA CUDA
PetaChem, LLC
Chemistry at the Speed of Graphics. Are you ready to accelerate your research? Accelerating Quantum Chemistry and Ab Initio Molecular Dynamics.
PetaChem, LLC
Chemistry at the Speed of Graphics. Welcome to the PetaChem Store. We invite you to create an account with us if you like, or shop as a guest. Either way, your shopping cart will be active until you leave the store. Thank you for visiting. TeraChem Academic - 1 License. TeraChem Academic- Multi License Pack. TeraChem Industry/Govt- Multi-License Pack.
petachem.com
PetaChem
http://www.petachem.com/news.html
May 25, 2016: TeraChem v1.9 will be released on June 15, 2016. New features include:. Polarizable Continuum Solvation with COSMO. Time-Dependent Density Functional Theory. Accelerated dynamics with virtual spherical piston. Ab Initio Steered Molecular Dynamics for Modeling External Force (Mechanochemistry). Easy combination of multiple basis sets. Polarizabilities for closed shell HF and DFT. Support for Fermi, Kepler, and Maxwell cards. All licensees are entitled to a free upgrade!
About PetaChem
http://www.petachem.com/about.html
PetaChem, LLC was founded in 2009 to promote the use of graphics processors (GPUs) for electronic structure theory and first principles molecular dynamics. Our flagship product is TeraChem, which was released in May, 2010 and is now at version 1.5. For a fully functional, free 30-day TeraChem trial version reach us here! Los Altos Hills, CA 94022. PetaChem, LLC 2009-2016.
PetaChem
http://www.petachem.com/accuracy.html
Comparison of energy during optimization for Ala. Using GAMESS and TeraChem. Both curves folow each other closely, demonstrating that the accuracy achieved by TeraChem is sufficient for geometry optimization problems. Final geometries are compared in the inset (TeraChem in full color and CPU-optimized in gold). RHF/6-31G calculations of Caffeine. Two-electron integral cutoff: 10. TeraChem, double precision on Tesla C2050. GAMESS, double precision. PetaChem, LLC 2009-2012.
PetaChem
http://www.petachem.com/pricing.html
Request price quote at sales@petachem.com. Purchase at our online store. 1 machine is one motherboard with up to 16 CPU cores (up to dual socket) and 8 GPUs. All licenses come with 6 months of E-mail based support (including free upgrades). TeraChem requires a 64-bit CPU with 64-bit Linux operating system and at least 1 NVIDIA GPU with at least CUDA 2.0 compute capability (Fermi). PetaChem, LLC recommends Intel Xeon series CPUs, CentOS 6.0 or later, and NVIDIA Kepler and Maxwell GPUs.
PetaChem
http://www.petachem.com/products.html
TeraChem is general purpose quantum chemistry software designed to run on NVIDIA GPU architectures under a 64-bit Linux operating system. Some of TeraChem features include:. Full support for NVIDIA GeForce/Tesla GPUs (GT200, Fermi, and Kepler). Restricted, unrestricted, and restricted open shell Hartree-Fock and grid-based Kohn-Sham energy and gradient calculations. Full support of s, p and d-type basis functions. Static and dynamical DFT grids. Empirical dispersion correction (DFT-D3 and DFT-D2). See Ta...
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Mergence Computing
http://www.mergencecomputing.com/oldMC/index.html
GPU accelerated" and "Many-Core SMP" parallel computing platforms. Expertly configured for Computational Chemistry. Serious computing on a laptop! Nvidia Fermi GTX480M CUDA™ acceleration. High performance GPU accelerated workstations and rackable systems to fit a variety of budgets. Not ready for GPU accelerated software? Try a 48-core workstation! And really you just want to get your calculations done. High performance workstations and laptops with NVIDIA Fermi. The first GPU accelerated.
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PetaChem
PetaChem, LLC is devoted to enabling quantum chemistry and first principles dynamics for molecular materials and biological molecules. Our focus is speed and we achieve this through redesign of modern algorithms for stream processors like the CUDA enabled GPU architectures from NVIDIA. Charge transfer upon solvation of BPTI. Ab initio molecular dynamics simulation (1ps) performed in hours using TeraChem on a desktop. Don't have GPUs yet and still want to try TeraChem? Register for free GPU Test Drive.
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