Thomas R. Cundari

Publication Activity (10 Years)

Years Active: 1997-2020
Publications (10 Years): 1

Top Topics

Machine Learning

Quantitative Analysis

Information Processing

Top Venues

J. Chem. Inf. Model.

Publications

Ignacio Migliaro, Thomas R. Cundari
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. J. Chem. Inf. Model. 60 (10) (2020)
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
-Formatics: How Do Proteins Bind Carbon Dioxide? J. Chem. Inf. Model. 49 (9) (2009)
Corneliu Buda, Abul B. Kazi, Adriana Dinescu, Thomas R. Cundari
Stability Studies of Transition-Metal Linkage Isomers Using Quantum Mechanical Methods. Groups 11 and 12 Transition Metals. J. Chem. Inf. Model. 45 (4) (2005)
Thomas R. Cundari, Costel Sârbu, Horia F. Pop
Robust Fuzzy Principal Component Analysis (FPCA). A Comparative Study Concerning Interaction of Carbon-Hydrogen Bonds with Molybdenum-Oxo Bonds. J. Chem. Inf. Comput. Sci. 42 (6) (2002)
Thomas R. Cundari, Marco Russo
Database Mining Using Soft Computing Techniques. An Integrated Neural Network-Fuzzy Logic-Genetic Algorithm Approach. J. Chem. Inf. Comput. Sci. 41 (2) (2001)
Thomas R. Cundari, Henry A. Kurtz, Tie Zhou
Modeling Intermolecular Effects on Nonlinear Optical Properties of Transition-Metal Complexes. An Effective Core Potential Study. J. Chem. Inf. Comput. Sci. 41 (1) (2001)
Thomas R. Cundari, Jun Deng, Horia F. Pop, Costel Sârbu
Structural Analysis of Transition Metal -X Substituent Interactions. Toward the Use of Soft Computing Methods for Catalyst Modeling. J. Chem. Inf. Comput. Sci. 40 (4) (2000)
Thomas R. Cundari, Jun Deng
PM3(tm) Analysis of Transition-Metal Complexes. J. Chem. Inf. Comput. Sci. 39 (2) (1999)
Thomas R. Cundari, Akihiko Yoshikawa
Computational study of methane activation by mercury(II) complexes. J. Comput. Chem. 19 (8) (1998)
Thomas R. Cundari, Jun Deng, Wentao Fu, Thomas R. Klinckman, Akihiko Yoshikawa
Molecular Modeling of Catalysts and Catalytic Reactions. J. Chem. Inf. Comput. Sci. 38 (6) (1998)
Thomas R. Cundari, L. C. Saunders
Modeling Lanthanide Coordination Complexes. Comparison of Semiempirical and Classical Methods. J. Chem. Inf. Comput. Sci. 38 (3) (1998)
Thomas R. Cundari, Eddie W. Moody
A Comparison of Neural Networks versus Quantum Mechanics for Inorganic Systems. J. Chem. Inf. Comput. Sci. 37 (5) (1997)