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Identification and characterization of fragment binding sites for allosteric ligand design using the site identification by ligand competitive saturation hotspots approach (SILCS-Hotspots)
MacKerell, Alexander D., Jo, Sunhwan, Lakkaraju, Sirish Kaushik, Lind, Christoffer, Yu, Wenbo
Published in Biochimica et biophysica acta. General subjects (01.04.2020)
Published in Biochimica et biophysica acta. General subjects (01.04.2020)
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Journal Article
Catalysts Containing the Adamantane Scaffold
Agnew-Francis, Kylie A., Williams, Craig M.
Published in Advanced synthesis & catalysis (03.03.2016)
Published in Advanced synthesis & catalysis (03.03.2016)
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Journal Article
Single‐Molecule Force Measurement Guides the Design of Multivalent Ligands with Picomolar Affinity
Yang, Zhen, Jiang, Sheng, Li, Feng, Qiu, Yatao, Gu, Jianhua, Pettigrew, Roderic I., Ferrari, Mauro, Hamilton, Dale J., Li, Zheng
Published in Angewandte Chemie International Edition (08.04.2019)
Published in Angewandte Chemie International Edition (08.04.2019)
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Journal Article
Ferrocene: an exotic building block for supramolecular assemblies
Guchhait, Chandrakanta, Suriyaa, Vembanan, Sahu, Nihar, Sarkar, Sovik Dey, Adhikari, Bimalendu
Published in Chemical communications (Cambridge, England) (07.12.2023)
Published in Chemical communications (Cambridge, England) (07.12.2023)
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Journal Article
Capturing the Trajectory of Metal-Ion-Cluster Formation: Stepwise Accumulation of Zn(II) Ions in a Robust Coordination Space Formed by a Rigid Tridentate Carboxylate Ligand
Kato, Mikiya, Fukui, Tomoya, Sato, Hiroyasu, Shoji, Yoshiaki, Fukushima, Takanori
Published in Inorganic chemistry (28.02.2022)
Published in Inorganic chemistry (28.02.2022)
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Journal Article
GRAIL: GRids of phArmacophore Interaction fieLds
Schuetz, Doris A, Seidel, Thomas, Garon, Arthur, Martini, Riccardo, Körbel, Markus, Ecker, Gerhard F, Langer, Thierry
Published in Journal of chemical theory and computation (11.09.2018)
Published in Journal of chemical theory and computation (11.09.2018)
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Journal Article
Chemically Controlled Helical Polymorphism in Protein Tubes by Selective Modulation of Supramolecular Interactions
Li, Zhen, Chen, Shuyu, Gao, Chendi, Yang, Zhiwei, Shih, Kuo-Chih, Kochovski, Zdravko, Yang, Guang, Gou, Lu, Nieh, Mu-Ping, Jiang, Ming, Zhang, Lei, Chen, Guosong
Published in Journal of the American Chemical Society (11.12.2019)
Published in Journal of the American Chemical Society (11.12.2019)
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Journal Article
Protein surface roughness accounts for binding free energy of Plasmepsin II‐ligand complexes
Valdés‐Tresanco, Mario E., Valdés‐Tresanco, Mario S., Valiente, Pedro A., Cocho, Germinal, Mansilla, Ricardo, Nieto‐Villar, J.M.
Published in Journal of molecular recognition (01.01.2018)
Published in Journal of molecular recognition (01.01.2018)
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Journal Article
A Sos proteomimetic as a pan-Ras inhibitor
Hong, Seong Ho, Yoo, Daniel Y., Conway, Louis, Richards-Corke, Khyle C., Parker, Christopher G., Arora, Paramjit S.
Published in Proceedings of the National Academy of Sciences - PNAS (04.05.2021)
Published in Proceedings of the National Academy of Sciences - PNAS (04.05.2021)
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Journal Article
Activatable T1 and T2 Magnetic Resonance Imaging Contrast Agents
Tu, Chuqiao, Osborne, Elizabeth A., Louie, Angelique Y.
Published in Annals of biomedical engineering (01.04.2011)
Published in Annals of biomedical engineering (01.04.2011)
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Journal Article
Noble Metal Complexes in Cancer Therapy: Unlocking Redox Potential for Next-Gen Treatments
Stefanache, Alina, Miftode, Alina Monica, Constantin, Marcu, Bogdan Goroftei, Roxana Elena, Olaru, Iulia, Gutu, Cristian, Vornicu, Alexandra, Lungu, Ionut Iulian
Published in Inorganics (01.02.2025)
Published in Inorganics (01.02.2025)
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Journal Article
Activatable T 1 and T 2 Magnetic Resonance Imaging Contrast Agents
Tu, Chuqiao, Osborne, Elizabeth A., Louie, Angelique Y.
Published in Annals of biomedical engineering (01.04.2011)
Published in Annals of biomedical engineering (01.04.2011)
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Journal Article
Single-Molecule Force Measurement Guides the Design of Multivalent Ligand with Picomolar Affinity
Yang, Zhen, Jiang, Sheng, Li, Feng, Qiu, Yatao, Gu, Jianhua, Pettigrew, Roderic I., Ferrari, Mauro, Hamilton, Dale J., Li, Zheng
Published in Angewandte Chemie International Edition (18.02.2019)
Published in Angewandte Chemie International Edition (18.02.2019)
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Journal Article
Computer-aided design and activity prediction of leucine aminopeptidase inhibitors
Grembecka, J., Sokalski, W.A., Kafarski, P.
Published in Journal of computer-aided molecular design (01.08.2000)
Published in Journal of computer-aided molecular design (01.08.2000)
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Journal Article