Scientific Consulting

A wide range of expertise in physical / analytical / computational chemistry & ML model development.

Target Screening

Highly-accurate ML classification used for drug repurposing & as discriminators in generative models.

Property Prediction

Geometric & quantum structure information used to make accurate predictions.

Sample Analysis

A suite of mass spectrometric, liquid chromatographic, and ion mobility measurements for sample characterization.

Advanced AI

WaterMine scientists have developed advanced machine learning algorithms and new representations of molecular quantum structure to create some of the world's most accurate ML models for target screening and properties prediction.

'Fingerprinting' Molecules

WaterMine employs world-class analytical instrumentation and leading-edge data processing techniques to detect and identify chemical compounds. Our patented technology also enables us to determine a variety of molecular properties quickly from only nanograms of impure sample.

Our Mission

To accelerate scientific discovery by leveraging the power of artificial intelligence.

Our Vision

To be the powerhouse that drives innovation in science; to provide top quality AI/ML support for STEM businesses.


Every project is different. WaterMine will work with you to define deliverables, timelines, and budget.


$250per hour

  • Experimental Design
  • Workflow Planning
  • Computational Support
  • Data Acquisition and Processing
  • Computer Coding
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Chemical Sample Analysis

Contact Usprices vary with scope

  • Sample pre-processing
  • Liquid Chromatography Mass Spectrometry
  • High-resolution Mass Spectrometry
  • Differential Ion Mobility
  • ML-driven P-Chem Properties Determination
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