logo
CanyamAI summaries for academic research
language
MobileMobile
  • Phone FeatureWeChat Mini Program
EnglishEnglish
noticeNotice
BlogBlog
delete
arrow
Back
T

Tom K. Woo

university of ottawa

58H-index
244Paper Count
1.4WCitation Count
Published Papers 90
Publication Date
logo
How well do conventional atomistic simulations predict adsorption binding sites in metal–organic frameworks compared to experiment?
errmater. adv.
IF0
err2026-04-03
err0
errOAAI
errJake Burner †; Olivier Marchand †; Sari Warshawsky; Marco Gibaldi; Tom K. Woo
errShare
errSave
High-Throughput Screening of Experimental Metal–organic Frameworks for High Water Content Syngas Hydrogen Purification under Pressure Swing Adsorption Conditions
errACS Applied Materials and Interfaces
IF8.2
err2026-01-10
err0
PREAI
errJun Luo; Marco Gibaldi; Samira Rostom; Robert T. Symonds; Robin W. Hughes; Tom K. Woo
errShare
errSave
Generalizable classification of crystal structure error types using graph attention networks
errJ. Mater. Chem. A
IF9.5
err2025-09-30
err0
errOAAI
errMarco Gibaldi; Jun Luo; Andrew J. White; R. Alex Mayo; Cécile Pereira; Tom K. Woo
errShare
errSave
Incorporation of Ligand Charge and Metal Oxidation State Considerations into the Computational Solvent Removal and Activation of Experimental Crystal Structures Preceding Molecular Simulation
errJOURNAL OF CHEMICAL INFORMATION AND MODELING
IF5.3
err2024-12-23
err0
PREAI
errGibaldi, Marco; Kapeliukha, Anna; White, Andrew; Woo, Tom K.
errShare
errSave
MEPO-ML: a robust graph attention network model for rapid generation of partial atomic charges in metal-organic frameworks
errNPJ COMPUTATIONAL MATERIALS
IF11.9
err2024-09-18
err1
errOAAI
errLuo, Jun; Said, Omar Ben; Xie, Peigen; Gibaldi, Marco; Burner, Jake; Pereira, Cecile; Woo, Tom K.
errShare
errSave
Hydrogen Adsorption in Ultramicroporous Metal-Organic Frameworks Featuring Silent Open Metal Sites
errACS APPLIED MATERIALS & INTERFACES
IF8.2
err2023-11-01
err2
errOAAI
errChiu, Nan Chieh; Compton, Dalton; Gladysiak, Andrzej; Simrod, Scott; Khivantsev, Konstantin; Woo, Tom K.; Stadie, Nicholas P.; Stylianou, Kyriakos C.
errShare
errSave
The Challenge of Water Competition in Physical Adsorption of CO2 by Porous Solids for Carbon Capture Applications - A Short Perspective
errADVANCED MATERIALS
IF26.8
err2023-07-26
err26
errOAAI
errRajendran, Arvind; Shimizu, George K. H.; Woo, Tom K.
errShare
errSave
ARC-MOF: A Diverse Database of Metal-Organic Frameworks with DFT-Derived Partial Atomic Charges and Descriptors for Machine Learning
errCHEMISTRY OF MATERIALS
IF7
err2023-01-20
err51
errOAAI
errBurner, Jake; Luo, Jun; White, Andrew; Mirmiran, Adam; Kwon, Ohmin; Boyd, Peter G.; Maley, Stephen; Gibaldi, Marco; Simrod, Scott; Ogden, Victoria; Woo, Tom K.
errShare
errSave
Molecular dynamics simulations of interfacial structure, dynamics, and interfacial tension of tetrabutylammonium bromide aqueous solution in the presence of methane and carbon dioxide
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2022-10-18
err5
errOAAI
errNaeiji, Parisa; Woo, Tom K.; Ohmura, Ryo; Alavi, Saman
errShare
errSave
The HEALED SBU Library of Chemically Realistic Building Blocks for Construction of Hypothetical Metal-Organic Frameworks
errACS APPLIED MATERIALS & INTERFACES
IF8.2
err2022-09-19
err11
errOAAI
errGibaldi, Marco; Kwon, Ohmin; White, Andrew; Burner, Jake; Woo, Tom K.
errShare
errSave
Inverse design of nanoporous crystalline reticular materials with deep generative models
errNATURE MACHINE INTELLIGENCE
IF23.9
err2021-01-11
err236
errOAAI
errYao, Zhenpeng; Sanchez-Lengeling, Benjamin; Bobbitt, N. Scott; Bucior, Benjamin J.; Kumar, Sai Govind Hari; Collins, Sean P.; Burns, Thomas; Woo, Tom K.; Farha, Omar K.; Snurr, Randall Q.; Aspuru-Guzik, Alan
errShare
errSave
High-Performing Deep Learning Regression Models for Predicting Low-Pressure CO2 Adsorption Properties of Metal-Organic Frameworks
errJOURNAL OF PHYSICAL CHEMISTRY C
IF3.2
err2020-12-09
err65
PREAI
errBurner, Jake; Schwiedrzik, Ludwig; Krykunov, Mykhaylo; Luo, Jun; Boyd, Peter G.; Woo, Tom K.
errShare
errSave
Molecular dynamics simulations of interfacial properties of the CO2-water and CO2-CH4-water systems
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2020-07-22
err27
PREAI
errNaeiji, Parisa; Woo, Tom K.; Alavi, Saman; Ohmura, Ryo
errShare
errSave
Prediction of MOF Performance in Vacuum Swing Adsorption Systems for Postcombustion CO2 Capture Based on Integrated Molecular Simulations, Process Optimizations, and Machine Learning Models
errENVIRONMENTAL SCIENCE & TECHNOLOGY
IF11.3
err2020-02-24
err136
PREAI
errBurns, Thomas D.; Pai, Kasturi Nagesh; Subraveti, Sai Gokul; Collins, Sean P.; Krykunov, Mykhaylo; Rajendran, Arvind; Woo, Tom K.
errShare
errSave
Molecular Dynamic Simulations of Clathrate Hydrate Anomalous Preservation: The Effect of Coating Clathrate Hydrate Phases
errJOURNAL OF PHYSICAL CHEMISTRY C
IF3.2
err2019-11-05
err12
PREAI
errNaeiji, Parisa; Woo, Tom K.; Alavi, Saman; Ripmeester, John A.
errShare
errSave
Interfacial properties of hydrocarbon/water systems predicted by molecular dynamic simulations
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2019-03-20
err32
PREAI
errNaeiji, Parisa; Woo, Tom K.; Alavi, Saman; Varaminian, Farshad; Ohmura, Ryo
errShare
errSave
Robust Machine Learning Models for Predicting High CO2 Working Capacity and CO2/H2 Selectivity of Gas Adsorption in Metal Organic Frameworks for Precombustion Carbon Capture
errJOURNAL OF PHYSICAL CHEMISTRY C
IF3.2
err2019-01-18
err132
PREAI
errDureckova, Hana; Krykunov, Mykhaylo; Aghaji, Mohammad Zein; Woo, Tom K.
errShare
errSave
Imparting gas selective and pressure dependent porosity into a non-porous solid via coordination flexibility
errMATERIALS HORIZONS
IF10.7
err2019-01-01
err18
PREAI
errNandi, Shyamapada; De Luna, Phil; Maity, Rahul; Chakraborty, Debanjan; Daff, Thomas; Burns, Thomas; Woo, Tom K.; Vaidhyanathan, Ramanathan
errShare
errSave
Design Strategy for the Controlled Generation of Cationic Frameworks and Ensuing Anion-Exchange Capabilities
errACS APPLIED MATERIALS & INTERFACES
IF8.2
err2018-12-28
err11
PREAI
errBrunet, Gabriel; Robeyns, Koen; Huynh, Racheal P. S.; Lin, Jian-Bin; Collins, Sean P.; Facey, Glenn A.; Shimizu, George K. H.; Woo, Tom K.; Murugesu, Muralee
errShare
errSave
Idealized Carbon-Based Materials Exhibiting Record Deliverable Capacities for Vehicular Methane Storage
errJOURNAL OF PHYSICAL CHEMISTRY C
IF3.2
err2018-12-06
err17
errOAAI
errCollins, Sean P.; Perim, E.; Daff, Thomas D.; Skaf, Munir S.; Galvao, Douglas S.; Woo, Tom K.
errShare
errSave

Research Directions

The data has not been retrieved yet.
Co-authors
Cooperation Journals
O
Omar K. Farha
H-index: 169 · Papers: 1.2K
R
Randall Q. Snurr
H-index: 116 · Papers: 648
罗
罗俊 (Jun Luo)
H-index: 115 · Papers: 490
A
Alán Aspuru‐Guzik
H-index: 114 · Papers: 940
L
Luigi Cavallo
H-index: 112 · Papers: 1.2K
View more