-
H. Wakefield IV,
Ilia Kevlishvili,
K. E. Wentz,
Y. Yao,
T. B. Kouznetsova,
S. J. Melvin,
E. G. Ambrosius,
A. Herzog-Arbeitman,
M. A. Siegler,
J. A. Johnson,
S. L. Craig,
Heather J. Kulik,
R. S. Klausen.
Synthesis and Ring-opening Metathesis Polymerization of a Strained trans-Silacycloheptene and Single Molecule Mechanics of its Polymer.
J. Am. Chem. Soc., in press.
-
Tomoaki Sakurada,
Yeongsu Cho,
Watcharaphol Paritmongkol,
Woo Seok Lee,
Ruomeng Wan,
Annlin Su,
Wenbi Shcherbakov-Wu,
Peter Müller,
Heather J. Kulik,
William A. Tisdale.
1D Hybrid Semiconductor Silver 2,6-Difluorophenylselenolate.
J. Am. Chem. Soc., 145, 5183-5190 (2023).
-
Keith E. L. Husted,
Christopher M. Brown,
Peyton Shieh,
Ilia Kevlishvili,
Samantha L. Kristufek,
Hadiqa Zafar,
Joseph V. Accardo,
Julian C. Cooper,
Rebekka S. Klausen,
Heather J. Kulik,
Jeffrey S. Moore,
Nancy R. Sottos,
Julia A. Kalow,
Jeremiah A. Johnson.
Remolding and Deconstruction of Industrial Thermosets via Carboxylic Acid-Catalyzed Bifunctional Silyl Ether Exchange.
J. Am. Chem. Soc., 145, 1916-1923 (2023).
-
Narayana Aluru,
Fikret Aydin,
Martin Z. Bazant,
Daniel Blankschtein,
Alexandra H. Brozena,
J. Pedro de Souza,
Menachem Elimelech,
Samuel Faucher,
John T. Fourkas,
Volodymyr B. Koman,
Matthias Kuehne,
Heather J. Kulik,
Hao-Kun Li,
Zhongwu Li,
Arun Majumdar,
Joel Martis,
Rahul Prasanna Misra,
Aleksandr Noy,
Tuan Anh Pham,
Haoran Qu,
Archith Rayabharam,
Mark A. Reed,
Cody L. Ritt,
Zuzanna Siwy,
Michael S. Strano,
Yuhuang Wang,
Cheng Zhan,
Ze Zhang.
Fluids and Electrolytes under Confinement in Single-Digit Nanopores.
Chem. Rev., 123 2737-2831 (2023).
-
Naveen Arunachalam,
Stefan Gugler,
Michael G. Taylor,
Chenru Duan,
Aditya Nandy,
Jon Paul Janet,
Ralf Meyer,
Jonas Oldenstaedt,
Daniel B. K. Chu,
Heather J. Kulik.
Ligand Additivity Relationships Enable Efficient Exploration of Transition Metal Chemical Space.
J. Chem. Phys., 157, 184112 (2022).
-
Christopher M. Brown,
David J. Lundberg,
Jessica R. Lamb,
Ilia Kevlishvili,
Denise Kleinschmidt,
Yasmeen S. Alfaraj,
Heather J. Kulik,
Maria Francesca Ottaviani,
Nathan J. Oldenhuis,
Jeremiah A. Johnson.
Endohedrally Functionalized Metal–Organic Cage-Cross-Linked Polymer Gels as Modular Heterogeneous Catalysts.
J. Am. Chem. Soc., 144, 13276–13284 (2022).
-
Heather J. Kulik,
Thomas Hammerschmidt,
Jonathan Schmidt,
Silvana Botti,
Miguel A. L. Marques,
Mario Boley,
Matthias Scheffler,
Milica Todorović,
Patrick Rinke,
Corey Oses,
Andriy Smolyanyuk,
Stefano Curtarolo,
Alexandre Tkatchenko,
Albert Bartok,
Sergei Manzhos,
Manabu Ihara,
Tucker Carrington,
Jörg Behler,
Olexandr Isayev,
Max Veit,
Andrea Grisafi,
Jigyasa Nigam,
Michele Ceriotti,
Kristoff T Schütt,
Julia Westermayr,
Michael Gastegger,
Reinhard Maurer,
Bhupalee Kalita,
Kieron Burke,
Ryo Nagai,
Ryosuke Akashi,
Osamu Sugino,
Jan Hermann,
Frank Noé,
Sebastiano Pilati,
Claudia Draxl,
Martin Kuban,
Santiago Rigamonti,
Markus Scheidgen,
Marco Esters,
David Hicks,
Cormac Toher,
Prasanna Balachandran,
Isaac Tamblyn,
Stephen Whitelam,
Colin Bellinger,
Luca M. Ghiringhelli.
Roadmap on Machine Learning in Electronic Structure.
Electron. Struct., 4, 023004 (2022).
-
Antonio Del Rio Flores,
David Kastner,
Y. Du,
Maanasa Narayanamoorthy,
Y. Shen,
Wenlong Cai,
Vyshnavi Vennelakanti,
N. A. Zill,
L. B. Dell,
Heather J. Kulik,
Wenjun Zhang.
Probing the mechanism of isonitrile formation by a non-heme iron(II)-dependent oxidase/decarboxylase.
J. Am. Chem. Soc., 144, 5893-5901 (2022).
-
Yuwen Zeng,
Pavlo Gordiichuk,
Takeo Ichihara,
Ge Zhang,
Xun Gong,
Sandoz-Rosado Emil,
Eric D. Wetzel,
Jason Tresback,
Jing Yang,
Zhongyue Yang,
Daichi Kozawa,
Matthias Kuehne,
Pingwei Liu,
Albert Tianxiang Liu,
Jingfan Yang,
Heather J. Kulik,
Michael S. Strano.
Irreversible synthesis of an ultrastrong two-dimensional polymeric material.
Nature, 602, 91-95 (2022).
-
Christopher D. Dawson,
Stephania M. Irwin,
Lindsey R. F. Backman,
Chip Le,
Jennifer X. Wang,
Vyshnavi Vennelakanti,
Zhongyue Yang,
Heather J. Kulik,
Catherine L. Drennan,
Emily P. Balskus.
Molecular basis of C-S bond cleavage in the glycyl radical enzyme isethionate sulfite-lyase.
Cell Chem. Biol., 28, 1333-1346 (2021).
-
Daniel G. A. Smith,
Annabelle T. Lolinco,
Zachary L. Glick,
Jiyoung Lee,
Asem Alenaizan,
Taylor A. Barnes,
Carlos H. Borca,
Roberto Di Remigio,
David L. Dotson,
Sebastian Ehlert,
Alexander G. Heide,
Michael F. Herbst,
Jan Hermann,
Colton B. Hicks,
Joshua T. Horton,
Adrian G. Hurtado,
Peter Kraus,
Holger Kruse,
Sebastian J. R. Lee,
Jonathon P. Misiewicz,
Levi N. Naden,
Farhad Ramezanghorbani,
Maximilian Scheurer,
Jeffrey B. Schriber,
Andrew C. Simmonett,
Johannes Steinmetzer,
Jeffrey R. Wagner,
Logan Ward,
Matthew Welborn,
Doaa Altarawy,
Jamshed Anwar,
John D. Chodera,
Andreas Dreuw,
Heather J. Kulik,
Fang Liu,
Todd J. Martínez,
Devin A. Matthews,
Henry F. Schaefer,
Jiří Šponer,
Justin M. Turney,
Lee-Ping Wang,
Nuwan De Silva,
Rollin A. King,
John F. Stanton,
Mark S. Gordon,
Theresa L. Windus,
C. David Sherrill,
Lori A. Burns.
Quantum Chemistry Common Driver and Databases (QCDB) and Quantum Chemistry Engine (QCEngine): Automation and interoperability among computational chemistry programs.
J. Chem. Phys., 155, 204801 (2021).
-
Rohan Jonnalagadda,
Antonio Del Rio Flores,
Wenlong Cai,
Rimsha Mehmood,
Maanasa Narayanamoorthy,
Chaoxiang Ren,
Jan Paulo T. Zaragoza,
Heather J. Kulik,
Wenjun Zhang,
Catherine L. Drennan.
Biochemical and crystallographic investigations into isonitrile formation by a nonheme iron-dependent oxidase/decarboxylase.
J. Biol. Chem., 296, 100231 (2021).
-
Seyed Mohamad Moosavi,
Aditya Nandy,
Kevin Maik Jablonka,
Daniele Ongari,
Jon Paul Janet,
Peter G. Boyd,
Yongjin Lee,
Berend Smit,
Heather J. Kulik.
Understanding the diversity of the metal-organic framework ecosystem.
Nat. Commun., 11, 4068 (2020).
-
Samuel Faucher,
Narayana Aluru,
Martin Z. Bazant,
Daniel Blankschtein,
Alexandra H. Brozena,
John Cumings,
J. Pedro de Souza,
Menachem Elimelech,
Razi Epsztein,
John T. Fourkas,
Ananth Govind Rajan,
Heather J. Kulik,
Amir Levy,
Arun Majumdar,
Charles Martin,
Michael McEldrew,
Rahul Prasanna Misra,
Aleksandr Noy,
Tuan Anh Pham,
Mark Reed,
Eric Schwegler,
Zuzanna Siwy,
Yuhuang Wang,
Michael Strano.
Critical Knowledge Gaps in Mass Transport through Single-Digit Nanopores: A Review and Perspective.
J. Phys. Chem. C, 123, 21309-21326 (2019).
-
Young-Gyun Park,
Chang Ho Sohn,
Ritchie Chen,
Margaret McCue,
Dae Hee Yun,
Gabrielle T. Drummond,
Taeyun Ku,
Nicholas B. Evans,
Hayeon Caitlyn Oak,
Wendy Trieu,
Heejin Choi,
Xin Jin,
Varoth Lilascharoen,
Ji Wang,
Matthias C. Truttmann,
Helena W. Qi,
Hidde L. Ploegh,
Todd R. Golub,
Shih-Chi Chen,
Matthew P. Frosch,
Heather J. Kulik,
Byung Kook Lim,
Kwanghun Chung.
Protection of tissue physicochemical properties using polyfunctional crosslinkers.
Nat. Biotechnol., 37, 73-83 (2019).
-
Wesley J. Transue,
Matthew Nava,
Maxwell W. Terban,
Jing Yang,
Matthew W. Greenberg,
Gang Wu,
Elizabeth S. Foreman,
Chantal L. Mustoe,
Pierre Kennepohl,
Jonathan S. Owen,
Simon J. L. Billinge,
Heather J. Kulik,
Christopher C. Cummins.
Anthracene as a Launchpad for a Phosphinidene Sulfide and for Generation of a Phosphorus–Sulfur Material Having the Composition P2S, a Vulcanized Red Phosphorus That Is Yellow.
J. Am. Chem. Soc., 141, 431-440 (2019).
-
Charles E. Diesendruck,
Gregory I. Peterson,
Heather J. Kulik,
Joshua A. Kaitz,
Brendan D. Mar,
Preston A. May,
Scott R. White,
Todd J. Martínez,
Andrew J. Boydston,
Jeffrey S. Moore.
Mechanically triggered heterolytic unzipping of a low-ceiling-temperature polymer.
Nat. Chem., 6, 623-628 (2014).