GPU-accelerated MCP server for molecular dynamics, N-body simulations, and particle systems
Connect Runs on your machine
claude mcp add molecular-mcp -- uvx scicomp-molecular-mcp==0.1.6
{
"mcpServers": {
"molecular-mcp": {
"command": "uvx",
"args": [
"scicomp-molecular-mcp==0.1.6"
]
}
}
}
{
"mcpServers": {
"molecular-mcp": {
"command": "uvx",
"args": [
"scicomp-molecular-mcp==0.1.6"
]
}
}
}
{
"servers": {
"molecular-mcp": {
"type": "stdio",
"command": "uvx",
"args": [
"scicomp-molecular-mcp==0.1.6"
]
}
}
}
Tools
This server runs locally, so its tools are listed by your MCP client once it starts.
Details
| Package | [email protected] (PYPI, stdio) |
| First published | 5 Jan 2026 |
| Last updated | 5 Jan 2026 |
| Registry name | io.github.andylbrummer/molecular-mcp |
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