Thomas R. Cundari

According to our database, Thomas R. Cundari authored at least 12 papers between 1997 and 2020.

Collaborative distances:

• Dijkstra number of four.
• Erdős number of four.

2020

Density Functional Study of Methane Activation by Frustrated Lewis Pairs with Group 13 Trihalides and Group 15 Pentahalides and a Machine Learning Analysis of Their Barrier Heights.

Ignacio Migliaro, Thomas R. Cundari

J. Chem. Inf. Model., 2020

2009

CO₂-Formatics: How Do Proteins Bind Carbon Dioxide?

Thomas R. Cundari, Angela K. Wilson, Michael L. Drummond, Hector Emanuel Gonzalez, Kameron R. Jorgensen, Stacy Payne, Jordan Braunfeld, Margarita De Jesus, Vanessa M. Johnson

J. Chem. Inf. Model., 2009

2005

Stability Studies of Transition-Metal Linkage Isomers Using Quantum Mechanical Methods. Groups 11 and 12 Transition Metals.

Corneliu Buda, Abul B. Kazi, Adriana Dinescu, Thomas R. Cundari

J. Chem. Inf. Model., 2005

2002

Robust Fuzzy Principal Component Analysis (FPCA). A Comparative Study Concerning Interaction of Carbon-Hydrogen Bonds with Molybdenum-Oxo Bonds.

Thomas R. Cundari, Costel Sârbu, Horia F. Pop

J. Chem. Inf. Comput. Sci., 2002

2001

Database Mining Using Soft Computing Techniques. An Integrated Neural Network-Fuzzy Logic-Genetic Algorithm Approach.

Thomas R. Cundari, Marco Russo

J. Chem. Inf. Comput. Sci., 2001

Modeling Intermolecular Effects on Nonlinear Optical Properties of Transition-Metal Complexes. An Effective Core Potential Study.

Thomas R. Cundari, Henry A. Kurtz, Tie Zhou

J. Chem. Inf. Comput. Sci., 2001

2000

Structural Analysis of Transition Metal -X Substituent Interactions. Toward the Use of Soft Computing Methods for Catalyst Modeling.

Thomas R. Cundari, Jun Deng, Horia F. Pop, Costel Sârbu

J. Chem. Inf. Comput. Sci., 2000

1999

PM3(tm) Analysis of Transition-Metal Complexes.

Thomas R. Cundari, Jun Deng

J. Chem. Inf. Comput. Sci., 1999

1998

Modeling Lanthanide Coordination Complexes. Comparison of Semiempirical and Classical Methods.

Thomas R. Cundari, L. C. Saunders

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

Molecular Modeling of Catalysts and Catalytic Reactions.

Thomas R. Cundari, Jun Deng, Wentao Fu, Thomas R. Klinckman, Akihiko Yoshikawa

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

Computational study of methane activation by mercury(II) complexes.

Thomas R. Cundari, Akihiko Yoshikawa

J. Comput. Chem., 1998

1997

A Comparison of Neural Networks versus Quantum Mechanics for Inorganic Systems.

Thomas R. Cundari, Eddie W. Moody

J. Chem. Inf. Comput. Sci., 1997