Schrödinger Materials Science AutoQSAR for Machine Learning

Build quantitative structure-activity relationships (QSAR) automatically for molecular systems with Schrödinger's AutoQSAR tool

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Version 1.0 - published on 11 Sep 2023

doi:10.21981/HF3S-T045 cite this

This tool is closed source.

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Usage

World usage

Location of all "Schrödinger Materials Science AutoQSAR for Machine Learning" Users Since Its Posting

Cumulative Simulation Users

73

1 22 68 68 69 69 73 73

Simulation Runs

361

2 74 335 335 337 337 359 361
Overview
Average Total
Wall Clock Time 3.08 hours 23.13 days
CPU time 0.19 seconds 34.88 seconds
Interaction Time 1.3 hours 9.76 days