NAMD Simulations & VMD Visualization GPU Workstations & Servers

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GPU-Accelerated MD

Accelerate MD tasks with the latest NVIDIA GPUs, such as H100, L40S, RTX PRO 6000 Blackwell, RTX 50-Series 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.

GPU Workstations Optimized for NAMD & VMD

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AMD Ryzen 9000X/7000X Series Dual GPUWorkstation

VWS-197021938

Starting at

$4,633.20

Highlights
CPU1x AMD Ryzen 9000X/7000X Series CPU (AM5)
GPUUp to 2x NVIDIA RTX PRO 6000 Blackwell Max-Q, RTX 5080, and more.
MEM4x DDR4 Memory Slots (Up to 128GB)
STO3x M.2 + 8x Internal Drives
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AMD Threadripper PRO Quad GPUWorkstation

VWS-109471812

Starting at

$7,773.70

Highlights
CPU1x AMD Ryzen Threadripper PRO 5000WX
GPUUp to 4x NVIDIA RTX PRO 6000 Blackwell or 2x RTX 5090/5080, and more
MEM8x DDR4 ECC Memory Slots (Up to 1TB)
STO2x M.2 + 8x Internal Drives
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Dual Xeon Scalable Multi-GPUWorkstation

TWS-115999024

Starting at

$10,243.20

Highlights
CPU2x 3rd Gen Intel Xeon Scalable Series
GPUUp to 4x NVIDIA H100, RTX 6000, 5000, 4500 Ada, and more
MEM16x DDR4 ECC Memory Slots (Up to 2TB)
STO8x 3.5" Hot-swap + 2x M.2 Slots

Multi-GPU Servers Optimized for NAMD & VMD

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Quad GPU Intel Xeon Scalable 2UServer

TS2-100183160

Starting at

$8,989.20

Highlights
CPU2x 4th/5th Gen Intel Xeon Scalable CPUs
GPUUp to 4x Double-Wide GPUs: NVIDIA H100 NVL, RTX PRO 6000 Blackwell, and more
MEM16 DDR5 ECC DIMM Slots (Up to 2TB)
STO4x 3.5" + 2x 2.5" Hot-swap Drives
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10x GPU Dual AMD EPYC 4UServer

TS4-130227231

Starting at

$22,909.70

Highlights
CPU2x AMD EPYC 9005/9004 CPUs
GPUUp to 8x Double-Wide GPUs: NVIDIA H200 NVL, RTX PRO 6000 Blackwell, and more
MEM24x DDR5 ECC DIMM Slots (Up to 3TB)
STOUp to 16x 2.5" NVMe Hot-Swap
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10x GPU Dual Intel Xeon 6700 4UServer

TS4-152232257

Starting at

$25,679.50

Highlights
CPU2x Intel Xeon 6700-series CPUs
GPUUp to 10x Double-Wide GPUs: NVIDIA H200 NVL, RTX PRO 6000 Blackwell, and more
MEM32x DIMM Slots DDR5 ECC (up to 4TB)
STO24x 2.5" Hot-Swap
namd gpu graph

GPU-Powered NAMD Solutions Significantly Reduce Time to Solution

Breakthroughs in GPU Acceleration for High-Performance Computing (HPC) have yielded rapid advancements in Molecular Dynamics (MD). Scaling multiple GPUs for NAMD simulations introduces a high degree of parallelism for calculating forces, enabling performance level increases of up to 600% versus running CPU only.

System Specs: Intel Xeon W-3945X (56 Cores) 4.8GHz CPU, 512GB DDR5, 1.92TB M.2 NVMe SSD

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

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