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GROMACS Certified GPU Systems

GROMACS Certified MD Systems
Certified GPU Workstations and Clusters
GPU Accelerated for Faster MD Simulation
GROMACS is a versatile package to perform molecular dynamics, i.e. simulate the Newtonian equations of motion for systems with hundreds to millions of particles. By leveraging the CUDA parallel processing architecture of NVIDIA GPUs, GPU acceleration is now a core part of GROMACS that works in combination with GROMACS' domain decomposition and load balancing code, delivering performance up to 5x when compared to CPU-only processing.
Interested in GPU accelerated cryo-electron microscopy using Relion software? We offer certified platforms that offer significant speed improvements to image processing, reconstruction, structural analysis, and modeling.
GROMACS Certified GPU Systems
The power of GPU computing has been to bring supercomputer power and performance to individual desktops with an economical price and high power efficiency. Exxact Corporation has teamed up with the GROMACS development team to design a series of certified GROMACS GPU solutions that provide the optimum price performance for the widest range of researchers. These machines provide turnkey solutions for GROMACS, come preinstalled with the latest version and updates, are ready to run out of the box and provide guaranteed performance.
GROMACS Certified System Highlights
As the sole provider of GROMACS Certified Systems, Exxact develops turnkey solutions in collaboration with key GROMACS developers to provide value-add systems for GPU accelerated molecular modeling and cheminformatics solutions.
• Designed to meet the requirements for MD simluation
• Guaranteed to be optimized to meet or exceed the published performance numbers
• Preinstalled GROMACS GPU computing solutions, designed in collaboration and genuinely certified by GROMACS Developers
• Includes example job submission scripts, benchmarks, fully validated test suite and latest software patches for quick implementation
• Save time installing, optimizing, benchmarking and validating and instead do more science
• Fully customizable to meet your budget
GROMACS Certified GPU Workstations
GROMACS Certified
Entry-Level Workstation
GROMACS Certified
Mid-Level Workstation
GROMACS Certified
High-End Workstation
Tensor TXR500-032R Tensor TXR433-0064R Tensor TXR434-0064R
• 1x Intel Core i7-5930K CPU
• 1x NVIDIA GTX 1070/1080 (Pascal) or Tesla K40/K20 GPU
• Upgrade option: NVIDIA TITAN X (Pascal), Quadro GP100, Quadro P6000, Quadro P5000
• 32 GB 2133MHz system memory
• GROMACS preinstalled, tested and optimized
• CentOS 6/ CentOS 7
• 3 year warranty
• 2x Intel Xeon E5-2620 v4 CPUs
• 2x NVIDIA GTX 1070/1080 (Pascal) or Tesla K80/K40 GPUs
• Upgrade option: NVIDIA TITAN X (Pascal), Quadro GP100, Quadro P6000, Quadro P5000
• 64 GB 2133MHz system memory
• GROMACS preinstalled, tested and optimized
• CentOS 6/ CentOS 7
• 3 year warranty
• 2x Intel Xeon E5-2640 v4 CPUs
• 4x NVIDIA GTX 1070/1080 (Pascal) or Tesla K80/K40 GPUs
• Upgrade option: NVIDIA TITAN X (Pascal), Quadro GP100, Quadro P6000, Quadro P5000
• 64 GB 2133MHz system memory
• GROMACS preinstalled, tested and optimized
• CentOS 6/ CentOS 7
• 3 year warranty
With 1x GTX1080 With 1x TITAN X
With 2x GTX1080s With 2x TITAN X
With 4x GTX 1080s With 4x TITAN X
$3999.00 Contact Us for Price
$5999.00 Contact Us for Price
$7999.00 Contact Us for Price
View Spec View Spec View Spec
View GROMACS Benchmark with NVIDIA GPU accelerators
GROMACS Certified
Mid-Level Workstation
GROMACS Certified
High-End Workstation
Tensor TXR410-1024R-LFE Tensor TXR410-1024R-LFE2
• 2x Intel Xeon processor Scalable family
• 2x NVIDIA GTX 1070/1080 (Pascal) or Tesla K80/K40 GPUs
• Upgrade option: NVIDIA TITAN X (Pascal), Quadro GP100, Quadro P6000, Quadro P5000
• Up to 64 GB DDR4 2133MHz system memory
• GROMACS preinstalled, tested and optimized
• CentOS 6 / CentOS 7
• 3 year warranty

• 2x Intel Xeon processor Scalable family
• 4x NVIDIA GTX 1070/1080 (Pascal) or Tesla K80/K40 GPUs
• Upgrade option: NVIDIA TITAN X (Pascal), Quadro GP100, Quadro P6000, Quadro P5000
• Up to 64 GB DDR4 2133MHz system
memory
• GROMACS preinstalled, tested and optimized
• CentOS 6 / CentOS 7
• 3 year warranty

With 2x GTX 1080s With 2x TITAN X
With 4x GTX 1080s With 4x TITAN X
$6499.00 Contact Us for Price
$8499.00 Contact Us for Price
View Spec View Spec
View GROMACS Benchmark with NVIDIA GPU accelerators
GROMACS Certified GPU Servers
GROMACS Certified
High Performance GPU Server
GROMACS Certified
High Performance GPU Server
GROMACS Certified
High Density GPU Server
Tensor TXR231-1000R Tensor TXR216-1024R Tensor TXR430-0768R
• 2x Intel Xeon E5-2600 v4 CPUs
• Up to 4x NVIDIA Tesla V100 / P100 / P40 / M40 / K80 / K40 GPUs
• Up to 1TB 2133MHz system memory
• GROMACS preinstalled, tested and optimized
• CentOS 6/ CentOS 7
• 3 year warranty
• 2x Intel Xeon processor Scalable family
• Up to 4x NVIDIA Tesla V100 / P100 / P40 / M40 / K80 / K40 GPUs
• Up to 1TB 2133MHz system memory
• GROMACS preinstalled, tested and optimized
• CentOS 6/ CentOS 7
• 3 year warranty
• 2x Intel Xeon E5-2600 v4 CPUs
• Up to 4x NVIDIA Tesla V100 / P100 / P40 / M40 / K80 / K40 GPUs
• Up to 768GB 2133MHz system memory
• GROMACS preinstalled, tested and optimized
• CentOS 6/ CentOS 7
• 3 year warranty
Contact Us for Price Contact Us for Price Contact Us for Price
View Spec View Spec View Spec
GROMACS Certified MD Cluster
Tensor TXR111-1000R
3x NVIDIA Tesla GPUs
• 2x Intel Xeon processor Scalable family
• 1U Server, Up to1TB DDR4
Tensor TXR230-0512R
4x NVIDIA Tesla GPUs
• 2x Intel Xeon E5-2600 v4 CPUs
• 1U Server, Up to 512GB DDR4
Tensor TXR216-1024R
4x NVIDIA Tesla GPUs
• 2x Intel Xeon processor Scalable family
• 2U Server, Up to 1TB DDR4
Tensor TXR430-0512R
4x NVIDIA Tesla GPUs
• 2x Intel Xeon E5-2600 v4 CPUs
• 4U Server, Up to 512GB DDR4
Tensor TXR430-0768R
8x NVIDIA Tesla GPUs
• 2x Intel Xeon E5-2600 v4 CPUs
• 4U Server, Up to 768GB DDR4
• GPU Options: NVIDIA Tesla V100, P100, P40, M40, K80, K40
• GROMACS preinstalled, tested and optimized
• Optional InfiniBand QDR Switch & HCAs
• Bright Computing Cluster Manager

Request a Quote for a customized GROMACS Certified cluster today!.
FREE GROMACS GPU Systems Test Drive
Exxact is also offering a special opportunity to remotely simulate your molecule file using a Kepler-based systems for free. No obligations or strings attached. The Exxact test drive program will provide you GPU computing systems with GROMACS that are thoroughly tested to ensure interoperability. Sign up now to experience the acceleration.