Grzybowski Group Publications : 2020s   




Mixed-Charge Nanocarriers Allow for Selective Targeting of Mitochondria by Otherwise Nonselective Dyes

D. V. Kolygina, M. Siek, M. Borkowska, G. Ahumada, P. Barski, D. Witt, A.-Y. Jee, H. Miao, J. C. Ahumada, S. Granick, K. Kandere-Grzybowska*, and B. A. Grzybowski*

ACS Nano (2021, IN PRESS)



Scaffold-Directed Face Selectivity Machine-Learned from Vectors of Non-covalent Interactions

M. Moskal, W. Beker, S. Szymkuc, B. A. Grzybowski*

Angew. Chem. Int. Ed. 60, 1-7 (2021)



Transistors and logic circuits based on metal nanoparticles and ionic gradients

Xing Zhao, Liu Yang, Jiahui Guo, Tao Xiao, Yi Zhou, Yuchun Zhang, Bin Tu, Tiehu Li, Bartosz A. Grzybowski, Yong Yan

Nature Electronics 4, 109-115 (2021)



On-Nanoparticle Gating Units Render an Ordinary Catalyst Substrate- and Site-Selective

M. Kim, M. Dygas, Y. I. Sobolev, W. Beker, Q. Zhuang, T. Klucznik, G. Ahumada, J.C. Ahumada & B. A. Grzybowski*

J. Am. Chem. Soc. 143, 1807-1815 (2021)




Chemist Ex Machina: Advanced Synthesis Planning by Computers

K. Molga, S. Szymkuc, B.A. Grzybowski* 

Acc. Chem. Res. 54, 1094-1106 (2021) COVER ART




Synthetic planning, reaction discovery and design of chemical systems using computers

B. A. Grzybowski* 

Proc. 25th Solvay Conf. Chem. (2021, in press) 





Mixed-Charge, pH-Responsive Nanoparticles for Selective Interactions with Cells, Organelles, and Bacteria

Marta Siek, Kristiana Kandere-Grzybowska*, and Bartosz A. Grzybowski*

Acc. Mater. Res. 1, 188-200 (2020) 



Computational planning of the synthesis of complex natural products

Barbara Mikulak-Klucznik, Patrycja Golebiowska, Alison A. Bayly, Oskar Popik, Tomasz Klucznik, Sara Szymkuc, Ewa P. Gajewska, Piotr Dittwald, Olga Staszewska-Krajewska, Wiktor Beker, Tomasz Badowski, Karl A. Scheidt, Karol Molga*, Jacek Mlynarski*, Milan Mrksich* and Bartosz A. Grzybowski*

Nature 588, 83-88 (2020)




Concentric liquid reactors for chemical synthesis and separation

Olgierd Cybulski, Miroslaw Dygas, Barbara Mikulak-Klucznik, Marta Siek, Tomasz Klucznik, Seong Yeol Choi, Robert J. Mitchell, Yaroslav I. Sobolev and Bartosz A. Grzybowski*

Nature 586, 57-63 (2020) COVER ART



Synthetic connectivity, emergence, and self-regeneration in the network of prebiotic chemistry

Agnieszka Wolos, Rafal Roszak, Anna Zadlo-Dobrowolska, Wiktor Beker, Barbara Mikulak-Klucznik, Grzegorz Spolnik, Miroslaw Dygas, Sara Szymkuc* and Bartosz A. Grzybowski*

Science 369, 1955 (2020) 




Minimal-uncertainty prediction of general drug-likeness based on Bayesian neural networks

Wiktor Beker, Agnieszka Wolos, Sara Szymkuc and Bartosz A. Grzybowski*

Nature Machine Intelligence 2, 457-465 (2020)




Suggestions for second-pass anti-COVID-19 drugs based on the Artificial Intelligence measures of molecular similarity ...

Martyna Moskal, Wiktor Beker, Rafal Roszak, Ewa P. Gajewska, Agnieszka Wolos, Karol Molga, Sara Szymkuc, Grzegorz Grynkiewicz and Bartosz A. Grzybowski*

ChemRxiv (2020) 



Targeted crystallization of mixed-charge nanoparticles in lysosomes induces selective death of cancer cells

Magdalena Borkowska, Marta Siek, Diana V. Kolygina, Yaroslav I. Sobolev, Slawomir Lach, Sumit Kumar, Yoon-Kyoung Cho, Kristiana Kandere-Grzybowska* & Bartosz A. Grzybowski*

Nature Nanotechnology 15, 331-341 (2020) COVER ART




Enhancing crystal growth using polyelectrolyte solutions and shear flow

Jian-Ke Sun, Yaroslav I. Sobolev, Weiyi Zhang, Qiang Zhuang and Bartosz A. Grzybowski*

Nature 579, 73-79 (2020)




Shaping Microcrystals of Metal-Organic Frameworks by Reaction-Diffusion

Jun Heuk Park, Jan Paczesny, Namhun Kim and Bartosz A. Grzybowski*

Angew. Chem. Int. Ed59, 10301 (2020)




Algorithmic Discovery of Tactical Combinations for Advanced Organic Syntheses

Ewa P.Gajewska, SaraSzymkuc, PiotrDittwald, Michal Startek, Oskar Popik, Jacek Mlynarski* and Bartosz A. Grzybowski*
Chem 6, 3-4 (2020)




Synergy Between Expert and Machine-Learning Approaches Allows for Improved Retrosynthetic Planning

Tomasz Badowski, Ewa P. Gajewska, Karol Molga and Bartosz A. Grzybowski*

Angew. Chem. Int. Ed59, 725 (2020)




Old drugs in new therapeutic indications - the case of chloroquine

Grzybowski, Bartosz A., Grynkiewicz, Grzegorz

Polish Technical Review 1, 5-10 (2020) COVER ART



Computer-generated "synthetic contingency" plans at times of logistics and supply problems: scenarios for hydroxychloroquine and remdesivir

Sara Szymkuc, Ewa P. Gajewska, Karol Molga, Agnieszka Wolos, Rafal Roszak, Wiktor Beker, Martyna Moskal, Piotr Dittwald and Bartosz A. Grzybowski*

Chem. Sci. 11, 6736-6744 (2020)




Additive Contact Polarization of Nonferroelectric Polymers for Patterning of Multilevel Memory Elements

Witold Adamkiewicz, Marta M. Siek, Tomasz W. Mazur, Slawomir Lach, and Bartosz A. Grzybowsk*

ACS Applied Materials & Interfaces, 12, 1504-1510 (2020)



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