AI-guided inverse morphology design for liquid-liquid encapsulation.

INTERACT-Morph turns high-speed videos, physics-readable observables, and uncertainty-aware models into a lab-facing design-decision tool for impact-driven liquid-shell morphology.

Problem

Morphology, not just wrapping success, controls shell thickness, trapped air, crown formation, encapsulated volume, layer sequence, and future function.

Core idea

Fuse material descriptors, high-speed interface trajectories, calibrated uncertainty, and constrained Bayesian optimization into an inverse design layer.

Deliverable

A documented software tool that recommends operating conditions with uncertainty, nearby prior evidence, constraints, and failure-mode warnings.

Why it matters

The actionable material state is morphology.

Liquid-liquid encapsulation experiment in the lab

Liquid-liquid encapsulation can wrap a liquid cargo inside an immiscible liquid shell in milliseconds. The opportunity is broader than making a wrapped droplet: shell morphology controls protection, diffusion length, buoyancy, stability, layer contact order, and downstream release or reaction.

The design challenge is inverse. Experimentalists need to know which impact height, shell volume, confinement geometry, or multilayer route will produce a target shell thickness, nonuniformity, trapped-air fraction, crown index, encapsulated volume, or layer sequence.

Computational stack

Four layers from transient interfaces to target morphology.

01

Dataset foundation

Existing and new high-speed videos, post-encapsulation images, fluid properties, impact heights, shell volumes, loop geometries, and annotation status are frozen into reproducible snapshots.

02

Video state inference

Domain-adapted segmentation tracks the core, host interface, shell lens, air cavity, loop boundary, and final cargo, producing physically meaningful time-series observables.

03

Morphology prediction

A multitask forward model predicts wrapping mode, penetration versus trapping, loop failure, shell thickness, crown index, trapped air, encapsulated volume, core offset, and layer sequence.

04

Inverse design

A constrained optimization layer recommends candidate experiments for a requested morphology while exposing uncertainty, constraint violations, nearest prior experiments, and extrapolation warnings.

Experimental scope

Focused scope buckets.

Experimental liquid-liquid encapsulation setup
Family A

Conventional encapsulation

Impact-driven wrapping, penetration/trapping boundaries, low-air operating windows, shell thickness, crown formation, and encapsulated volume across material and process descriptors.

Family B

Loop-assisted confinement

Circular-loop confinement and finite shell-volume windows, including minimum usable volume, overflow limits, crown suppression, and constrained interfacial-layer behavior.

Family C

Limited multilayer route decisions

Selected direct-impact versus Y-junction-assisted multilayer cases where layer ordering, density, and interfacial-tension constraints determine feasible morphology.

Success criteria

Validation gates tied to prospective experimental usefulness.

10-20% Improvement over thermodynamic or regime-map baselines for mode prediction
Top-3 Recommended conditions for target morphologies with calibrated uncertainty
30% Reduction in experiments needed to map useful operating windows
Artifacts Dataset card, model card, validation report, and failure-mode map

Workplan

The route to a validated morphology planner.

Freeze the data foundation, dataset schema, dataset card, initial segmentation/tracking, and thermodynamic/regime-map baselines.

Run targeted conventional and loop-assisted experiments across impact height, shell volume, penetration/trapping boundaries, low-air regions, and loop windows.

Train the first observable-aware multitask model and compare against held-out operating windows and baseline predictors.

Refine morphology regression, uncertainty calibration, out-of-domain checks, and selective fluorescence or microscopy calibration.

Build the inverse recommendation engine, add the limited multilayer decision layer, and start prospective target-morphology campaigns.

Complete prospective validation, software release, benchmark workflows, model card, dataset card, and failure-mode map.

Team

Computational AI-for-science meets experimental interfacial matter.

INTERACT-Morph pairs Dr. Sirshendu Misra's impact-driven liquid-liquid encapsulation platform with Dr. Kevin Dsouza's AI-for-science, uncertainty-aware modeling, and research software background.

Dr. Sirshendu Misra

Dr. Sirshendu Misra

Primary applicant; experimental interfacial platform lead

Dr. Misra is a Ramanujan Fellow Faculty member at the Indian Institute of Science, Bengaluru. His prior work anchors the experimental platform: impact-driven wrapping, penetration and trapping, four-fluid interface dynamics, constrained interfacial layers, and multilayer encapsulation.

Dr. Kevin Dsouza

Dr. Kevin Dsouza

Equal co-applicant; AI, software, and model evaluation lead

Dr. Kevin Dsouza is an NSERC Postdoctoral Fellow at the Indian Institute of Science, Bengaluru. He leads the computational stack: video processing, physics-aware representation learning, uncertainty calibration, inverse recommendation, reproducible evaluation, and experimentalist-facing software workflows.

Waterloo foundation

From simple liquid-liquid wrapping to scalable encapsulation.

Research origin

University of Waterloo highlighted the original liquid-liquid wrapping work as a faster, lower-cost route for coating liquid medication. The method uses gravity and interfacial forces to wrap falling droplets in a liquid shell that can later cure and protect the core cargo.

Read the Waterloo News story

Commercialization path

Waterloo's commercialization office later described the platform as a simple, low-cost liquid-liquid encapsulation system with applications across pharmaceuticals, nutraceuticals, food and beverage, cosmetics, and personal care. That translation path motivates INTERACT-Morph's focus on reliable morphology planning for real experimental use.

Read the WatCo commercialization story

Selected papers

Project-relevant foundation and team track record.