Home
News
People
Prof. Kulik
Group Members
Alumni
Tutorials
molSimplify
MOFSimplify
Publications
Contact
2
Computational Screening of Putative Catalyst Transition Metal Complexes as Guests in a Ga₄L₆⁻¹² Nanocage
Metal-organic cages form well-defined microenvironments that can enhance the catalytic proficiency of encapsulated transition metal …
Clorice Reinhardt
,
Melissa Manetsch
,
Wan-Lu Li
,
Yuriy Roman-Leshkov
,
Teresa Head-Gordon
,
Heather J. Kulik
PDF
Cite
DOI
ChemRxiv
Metal–Organic Framework Stability in Water and Harsh Environments from Data-Driven Models Trained on the Diverse WS24 Data Set
Metal–organic frameworks (MOFs) are porous materials with applications in gas separations and catalysis, but a lack of water stability …
Gianmarco Terrones
,
Shih-Peng Huang
,
Matt Rivera
,
Shuwen Yue
,
Alondra Hernandez
,
Heather J. Kulik
PDF
Cite
DOI
ChemRxiv
Robust Chemiresistive Behavior in Conductive Polymer/MOF Composites
Metal-organic frameworks (MOFs) are promising materials for gas sensing but are often limited to single-use detection. A hybridization …
Heejung Roh
,
Dong-Ha Kim
,
Yeongsu Cho
,
Young-Moo Jo
,
Jesús A. del Alamo
,
Heather J. Kulik
,
Mircea Dinca
,
Aristide Gumyusenge
PDF
Cite
DOI
MIT News
Visible light–mediated aza Paternò–Büchi reaction of acyclic oximes and alkenes to azetidines
The aza Paternò–Büchi reaction is a [2+2]-cycloaddition reaction between imines and alkenes that produces azetidines, four-membered …
Emily R. Wearing
,
Yu-Cheng Yeh
,
Gianmarco Terrones
,
Seren G. Parikh
,
Ilia Kevlishvili
,
Heather J. Kulik
,
Corinna S. Schindler
PDF
Cite
DOI
ChemRxiv
MIT News
C&E News
The tension-activated carbon–carbon bond
Mechanical force drives distinct chemical reactions; yet, its vectoral nature results in complicated coupling with reaction …
Yunyan Sun
,
Ilia Kevlishvili
,
Tatiana B. Kouznetsova
,
Zach P. Burke
,
Stephen L. Craig
,
Heather J. Kulik
,
Jeffrey S. Moore
Cite
DOI
ChemRxiv
UIUC News
Heterocyclic Modification Leading to Luminescent 0D Metal Organochalcogenide with Stable X-ray Scintillating Properties
Metal organochalcogenides (MOCs) are an emerging class of luminescent hybrid organic–inorganic semiconductors, whose structures and …
Rattapon Khamlue
,
Tomoaki Sakurada
,
Yeongsu Cho
,
Woo Seok Lee
,
Pimpan Leangtom
,
Michael G. Taylor
,
Worakit Naewtong
,
Pongsakun Sripetch
,
Busayakorn Na Ranong
,
Tossawat Autila
,
Thiti Rungseesumran
,
Jakrapong Kaewkhao
,
Taweesak Sudyodsuk
,
Atcha Kopwitthaya
,
Peter Müller
,
Vinich Promarak
,
Heather J. Kulik
,
William A. Tisdale
,
Watcharaphol Paritmongkol
PDF
Cite
DOI
Internal Catalysis in Dynamic Hydrogels with Associative Thioester Cross-links
Thioesters are an essential functional group in biosynthetic pathways, which has motivated their development as reactive handles in …
Vivian Zhang
,
Carrie Ou
,
Ilia Kevlishvili
,
Christina M. Hemmingsen
,
Joseph V. Accardo
,
Heather J. Kulik
,
Julia A. Kalow
PDF
Cite
DOI
Nested Non-covalent Interactions Expand the Functions of Supramolecular Polymer Networks
Supramolecular polymer networks contain non-covalent cross-links that enable access to broadly tunable mechanical properties and …
David J. Lundberg
,
Christopher M. Brown
,
Eduard O. Bobylev
,
Nathan J. Oldenhuis
,
Yasmeen S. Alfaraj
,
Julia Zaho
,
Ilia Kevlishvili
,
Heather J. Kulik
,
Jeremiah A. Johnson
PDF
Cite
DOI
ChemRxiv
A semi-automated, high-throughput approach for the synthesis and identification of highly photo-cytotoxic iridium complexes
The discovery of new compounds with pharmacological properties is usually a lengthy, laborious and expensive process. Thus, there is …
Timothy Kench
,
Arielle Rahardjo
,
Gianmarco Terrones
,
Adinarayana Bellamkonda
,
Thomas E. Maher
,
Marko Storch
,
Heather J. Kulik
,
Ramon Vilar
PDF
Cite
DOI
A Thermally Stable SO₂ Releasing Mechanophore: Facile Activation, Single-Event Spectroscopy, and Molecular Dynamic Simulations
Polymers that release small molecules in response to mechanical force are promising candidates as next-generation on-demand delivery …
Yunyan Sun
,
William H. Neary
,
Xiao Huang
,
Tatiana B. Kouznetsova
,
Tetsu Ouchi
,
Ilia Kevlishvili
,
Kecheng Wang
,
Yingying Chen
,
Heather J. Kulik
,
Stephen L. Craig
,
Jeffrey S. Moore
PDF
Cite
DOI
«
»
Cite
×