NAMD Simulations & VMD Visualization GPU Workstations & Servers

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GPU Accelerated MD

Exxact features the latest GPU hardware. Accelerate MD tasks with NVIDIA H100, L40S, RTX 6000/5000/4500 Ada, RTX 4090/4080 and more.

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Platform Flexibility

Every GPU system we build is customized for each customer, and cross-compatible with many popular MD simulation suites.

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Do More Science!

Exxact systems are fully validated and tested, built to the highest standards, and ships with a standard 3 year warranty.

NAMD & VMD Optimized GPU Workstations

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AMD Ryzen 7000 Series Dual GPUWorkstation

VWS-197021938

Starting at

$4,301.00

Highlights
CPU1x AMD Ryzen 7000 Series Processor
GPUUp to 2x NVIDIA RTX 6000/5000/4500 Ada, 1x RTX 4090/4080, and more
MEM32GB DDR4 Memory [Up to 128GB]
STO3x M.2 + 6x 3.5" + 2x2.5" Internal Drives
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AMD Threadripper PRO Quad GPUWorkstation

VWS-148320247

Starting at

$7,326.00

Highlights
CPU1x AMD Ryzen Threadripper PRO 5000WX
GPUUp to 4x NVIDIA RTX 6000/5000/4500 Ada, 2x RTX 4090/4080, and more
MEM128GB DDR4 ECC (Up to 1TB)
STO2x M.2 + 6x 3.5" + 2x 2.5" Internal Drives
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Dual Xeon Scalable Multi-GPUWorkstation

TWS-115999024

Starting at

$9,649.20

Highlights
CPU2x 3rd Gen Intel Xeon Scalable Series
GPUUp to 4x NVIDIA RTX 6000, 5000, 4500 Ada, and more
MEM256GB DDR4 ECC (Up to 2TB)
STO8x 3.5" Hot-swap + 2x M.2 Slots

NAMD & VMD Optimized Multi-GPU Servers

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Quad GPU Intel Xeon Scalable 2UServer

TS2-197278655

Starting at

$7,977.20

Highlights
CPU2x 3rd Gen Intel Xeon Scalable CPUs
GPUUp to 10x Double-Wide GPUs: NVIDIA H100, or RTX 6000, 5000, 4500 Ada, & more.
MEM16 DDR4 ECC DIMM Slots (Up to 2TB)
STO8x 3.5" Hot Swap
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8x GPU Dual AMD EPYC 4UServer

TS4-194492555

Starting at

$12,567.50

Highlights
CPU2x AMD EPYC 7003/7003X CPUs
GPUUp to 8x Double-Wide GPUs: NVIDIA H100, or RTX 6000, 5000, 4500 Ada, & more.
MEM32 DDR4 ECC DIMM Slots (Up to 4TB)
STO8x 3.5" Hot-swap
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10x GPU Dual Intel Xeon Scalable 4UServer

TS4-114018381

Starting at

$12,771.00

Highlights
CPU2x 3rd Gen Intel Xeon Scalable CPUs
GPUUp to 10x Double-Wide GPUs: NVIDIA H100, or RTX 6000, 5000, 4500 Ada, & more.
MEM32x DIMM Slots DDR4 ECC (up to 8TB)
STO12x 3.5" Hot-Swap Drive
namd gpu graph

GPU Powered NAMD Solutions Significantly Reduce Time to Solution

Recent breakthroughs in GPU Acceleration for High-Performance Computing (HPC) have yielded rapid advancements in Molecular Dynamics (MD). Proper research of bio-molecular machines depends on simulations of 100 ns or longer. In molecular dynamics, force calculations between non-bonded atoms are time consuming and extensive. GPUs are the perfect solution due to their inherent high degree of parallelism and floating-point arithmetic capability, attaining performance levels up to twenty times that of a single CPU core.

System Specs: 2 x Intel Xeon Gold 6148 2.4GHz CPU, 192GB DDR4-2666, 3x480GB SSD w/RAID 0, NVIDIA Titan V 12GB GPU

Build your ideal system

Need a bit of help? Contact our sales engineers directly.

md software
Molecular Dynamics Software

Precise Tools for Precise Research

Gain peace of mind knowing that your system is ready for research the moment it's turned on. Each Exxact system goes through extensive validating and optimizing procedures before being shipped out. We pride ourselves on delivering turnkey solutions so you can spend less time configuring and more time researching.

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