Venkat Venkatasubramanian

N. Sanjeevrajan

Arun Sankar E. M.

Comput. Chem. Eng., 2025

2024

<i>eSFILES</i>: Intelligent process flowsheet synthesis using process knowledge, symbolic AI, and machine learning.

[BibT_eX]

[DOI]

Mauricio Sales-Cruz

Comput. Chem. Eng., February, 2024

What's in an embedding? Would a rose by any embedding smell as sweet?

[BibT_eX]

[DOI]

CoRR, 2024

Quo Vadis ChatGPT? From Large Language Models to Large Knowledge Models.

[BibT_eX]

[DOI]

CoRR, 2024

Density and Affinity Dependent Social Segregation and Arbitrage Equilibrium in a Multi-class Schelling Game.

[BibT_eX]

[DOI]

CoRR, 2024

Hybrid AI modeling techniques for pilot scale bubble column aeration: A comparative study.

[BibT_eX]

[DOI]

Peter Jul-Rasmussen

Xiaodong Liang

Jakob Kjøbsted Huusom

Comput. Chem. Eng., 2024

2023

SUSIE: Pharmaceutical CMC ontology-based information extraction for drug development using machine learning.

[BibT_eX]

[DOI]

Shekhar Viswanath

Shankarraman Vaidyaraman

Jeya Balakrishnan

Comput. Chem. Eng., November, 2023

Arbitrage Equilibrium, Invariance, and the Emergence of Spontaneous Order in the Dynamics of Bird-like Agents.

[BibT_eX]

[DOI]

Entropy, July, 2023

Jaynes Machine: The universal microstructure of deep neural networks.

[BibT_eX]

[DOI]

N. Sanjeevrajan

Manasi Khandekar

CoRR, 2023

G-MATT: Single-step Retrosynthesis Prediction using Molecular Grammar Tree Transformer.

[BibT_eX]

[DOI]

Kevin Zhang

CoRR, 2023

2022

AI-driven Hypernetwork of Organic Chemistry: Network Statistics and Applications in Reaction Classification.

[BibT_eX]

[DOI]

CoRR, 2022

A unified theory of emergent equilibrium phenomena in active and passive matter.

[BibT_eX]

[DOI]

Comput. Chem. Eng., 2022

2021

Robust and efficient swarm communication topologies for hostile environments.

[BibT_eX]

[DOI]

Swarm Evol. Comput., 2021

Editorial.

[BibT_eX]

[DOI]

Efstratios N. Pistikopoulos

Comput. Chem. Eng., 2021

Process systems engineering - <i>The generation next?</i>.

[BibT_eX]

[DOI]

Gintaras V. Reklaitis

Fengqi You

Comput. Chem. Eng., 2021

Retrosynthesis prediction using grammar-based neural machine translation: An information-theoretic approach.

[BibT_eX]

[DOI]

Comput. Chem. Eng., 2021

AI-DARWIN: A first principles-based model discovery engine using machine learning.

[BibT_eX]

[DOI]

Comput. Chem. Eng., 2021

2020

Hidden representations in deep neural networks: Part 1. Classification problems.

[BibT_eX]

[DOI]

Comput. Chem. Eng., 2020

Hidden representations in deep neural networks: Part 2. Regression problems.

[BibT_eX]

[DOI]

Comput. Chem. Eng., 2020

Mechanism discovery and model identification using genetic feature extraction and statistical testing.

[BibT_eX]

[DOI]

Lakshminarayanan Samavedham

Comput. Chem. Eng., 2020

2019

A One-Third Advice Rule Based on a Control-Theoretic Opinion Dynamics Model.

[BibT_eX]

[DOI]

Yu Luo

Garud Iyengar

IEEE Trans. Comput. Soc. Syst., 2019

Control of complex sociotechnical systems: Importance of causal models and game theory.

[BibT_eX]

[DOI]

Yu Luo

Zhizun Zhang

Comput. Chem. Eng., 2019

A hierarchical approach for causal modeling of process systems.

[BibT_eX]

[DOI]

Resmi Suresh

Comput. Chem. Eng., 2019

2018

Social Influence Makes Self-Interested Crowds Smarter: An Optimal Control Perspective.

[BibT_eX]

[DOI]

Yu Luo

Garud Iyengar

Miguel Francisco M. Remolona

IEEE Trans. Comput. Soc. Syst., 2018

2017

Hybrid ontology-learning materials engineering system for pharmaceutical products: Multi-label entity recognition and concept detection.

[BibT_eX]

[DOI]

Matthew F. Conway

Sriram Balasubramanian

Comput. Chem. Eng., 2017

2013

Generalized shape constrained spline fitting for qualitative analysis of trends.

[BibT_eX]

[DOI]

Kris Villez

Comput. Chem. Eng., 2013

2011

Kalman-based strategies for Fault Detection and Identification (FDI): Extensions and critical evaluation for a buffer tank system.

[BibT_eX]

[DOI]

Kris Villez

Babji Srinivasan

Shankar Narasimhan

Comput. Chem. Eng., 2011

Computers & Chemical Engineering: Best paper of 2009.

[BibT_eX]

[DOI]

Comput. Chem. Eng., 2011

An optimization framework for cost effective design of refueling station infrastructure for alternative fuel vehicles.

[BibT_eX]

[DOI]

Aviral Shukla

Joseph F. Pekny

Comput. Chem. Eng., 2011

Learning patterns in combinatorial protein libraries by Support Vector Machines.

[BibT_eX]

[DOI]

Sridhar Maddipati

Ravi Nandigam

Sangtae Kim

Comput. Chem. Eng., 2011

2010

Fairness Is an Emergent Self-Organized Property of the Free Market for Labor.

[BibT_eX]

[DOI]

Entropy, 2010

A framework for on-line trend extraction and fault diagnosis.

[BibT_eX]

[DOI]

Mano Ram Maurya

Praveen K. Paritosh

Eng. Appl. Artif. Intell., 2010

Editorial.

[BibT_eX]

[DOI]

Comput. Chem. Eng., 2010

An ontological framework for automated regulatory compliance in pharmaceutical manufacturing.

[BibT_eX]

[DOI]

M. Berkan Sesen

Pradeep Suresh

René Bañares-Alcántara

Comput. Chem. Eng., 2010

Providing Scalable Data Services in Ubiquitous Networks.

[BibT_eX]

[DOI]

Proceedings of the Database Systems for Advanced Applications, 2010

2009

What is Fair Pay for Executives? An Information Theoretic Analysis of Wage Distributions.

[BibT_eX]

[DOI]

Entropy, 2009

Breeding Diameter-Optimal Topologies for Distributed Indexes.

[BibT_eX]

[DOI]

Sanket Patil

Srinath Srinivasa

Saikat Mukherjee

Aditya Ramana Rachakonda

Complex Syst., 2009

Cyberinfrastructure, informatics, and intelligent systems: Commentary on the new thematic area for Computers and Chemical engineering.

[BibT_eX]

[DOI]

Comput. Chem. Eng., 2009

Editorial note.

[BibT_eX]

[DOI]

Andy Hrymak

Jay H. Lee

Comput. Chem. Eng., 2009

Classes of Optimal Network Topologies Under Multiple Efficiency and Robustness Constraints.

[BibT_eX]

[DOI]

Sanket Patil

Srinath Srinivasa

Proceedings of the IEEE International Conference on Systems, 2009

Engineering research center for structured organic particulate synthesis (ERC-SOPS).

[BibT_eX]

[DOI]

Arun Giridhar

Gintaras V. Reklaitis

Proceedings of the American Control Conference, 2009

2008

Preface - Reklaitis 65th birthday special issue.

[BibT_eX]

[DOI]

Ignacio E. Grossmann

Balachandra Krishnamurthy

Comput. Chem. Eng., 2008

A domain-specific compiler theory based framework for automated reaction network generation.

[BibT_eX]

[DOI]

Shuo-Huan Hsu

Prathima Rao

Chunhua Zhao

Suresh Jagannathan

Comput. Chem. Eng., 2008

High fidelity mathematical model building with experimental data: A Bayesian approach.

[BibT_eX]

[DOI]

Balachander Krishnamurthy

Comput. Chem. Eng., 2008

Rule-Based Classification Systems for Informatics.

[BibT_eX]

[DOI]

Tanu Malik

Stephen Stamatis

James M. Caruthers

Proceedings of the Fourth International Conference on e-Science, 2008

2007

Fault diagnosis using dynamic trend analysis: A review and recent developments.

[BibT_eX]

[DOI]

Mano Ram Maurya

Eng. Appl. Artif. Intell., 2007

A theory of design of complex teleological systems: Unifying the Darwinian and Boltzmannian perspectives.

[BibT_eX]

[DOI]

Complex., 2007

Pharmaceutical Informatics and the Pathway to Personalized Medicines.

[BibT_eX]

[DOI]

Sangtae Kim

Proceedings of the Computational Science, 2007

2006

Ontological informatics infrastructure for pharmaceutical product development and manufacturing.

[BibT_eX]

[DOI]

Gintaras V. Reklaitis

Comput. Chem. Eng., 2006

A systematic framework for the design of reduced-order models for signal transduction pathways from a control theoretic perspective.

[BibT_eX]

[DOI]

Comput. Chem. Eng., 2006

2005

Prognostic and diagnostic monitoring of complex systems for product lifecycle management: Challenges and opportunities.

[BibT_eX]

[DOI]

Comput. Chem. Eng., 2005

2004

Application of signed digraphs-based analysis for fault diagnosis of chemical process flowsheets.

[BibT_eX]

[DOI]

Mano Ram Maurya

Eng. Appl. Artif. Intell., 2004

Entropy Maximization as a Holistic Design Principle for Complex Optimal Networks and the Emergence of Power Laws

[BibT_eX]

[DOI]

Dimitris Nicolas Politis

Priyan R. Patkar

CoRR, 2004

Spontaneous emergence of complex optimal networks through evolutionary adaptation.

[BibT_eX]

[DOI]

Santhoji Katare

Priyan R. Patkar

Fangping Mu

Comput. Chem. Eng., 2004

A hybrid genetic algorithm for efficient parameter estimation of large kinetic models.

[BibT_eX]

[DOI]

Comput. Chem. Eng., 2004

2003

A review of process fault detection and diagnosis: Part I: Quantitative model-based methods.

[BibT_eX]

[DOI]

Kewen Yin

Surya N. Kavuri

Comput. Chem. Eng., 2003

A review of process fault detection and diagnosis: Part III: Process history based methods.

[BibT_eX]

[DOI]

Surya N. Kavuri

Kewen Yin

Comput. Chem. Eng., 2003

A review of process fault detection and diagnosis: Part II: Qualitative models and search strategies.

[BibT_eX]

[DOI]

Surya N. Kavuri

Comput. Chem. Eng., 2003

Fuzzy-logic based trend classification for fault diagnosis of chemical processes.

[BibT_eX]

[DOI]

Sourabh Dash

Comput. Chem. Eng., 2003

1998

Parametric Sensitivity and Search-Space Characterization Studies of Genetic Algorithms for Computer-Aided Polymer Design.

[BibT_eX]

[DOI]

Anantha Sundaram

J. Chem. Inf. Comput. Sci., 1998

1995

Evolutionary Design of Molecules with Desired Properties Using the Genetic Algorithm.

[BibT_eX]

[DOI]

King Chan

James M. Caruthers

J. Chem. Inf. Comput. Sci., 1995

1986

A blackboard architecture for plastics design.

[BibT_eX]

[DOI]