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Page 1
Editorial: Chemical Reactions Mining.
Madzhidov TI, Varnek A. Madzhidov TI, et al. Mol Inform. 2022 Sep;41(9):e2200044. doi: 10.1002/minf.202200044. Epub 2022 Apr 7. Mol Inform. 2022. PMID: 35338606 No abstract available.
Multiple Conformer Descriptors for QSAR Modeling.
Nikonenko A, Zankov D, Baskin I, Madzhidov T, Polishchuk P. Nikonenko A, et al. Among authors: madzhidov t. Mol Inform. 2021 Nov;40(11):e2060030. doi: 10.1002/minf.202060030. Epub 2021 Aug 3. Mol Inform. 2021. PMID: 34342944
SynPlanner: An End-to-End Tool for Synthesis Planning.
Akhmetshin T, Zankov D, Gantzer P, Babadeev D, Pinigina A, Madzhidov T, Varnek A. Akhmetshin T, et al. Among authors: madzhidov t. J Chem Inf Model. 2025 Jan 13;65(1):15-21. doi: 10.1021/acs.jcim.4c02004. Epub 2024 Dec 31. J Chem Inf Model. 2025. PMID: 39739735
Reaction Data Curation I: Chemical Structures and Transformations Standardization.
Gimadiev TR, Lin A, Afonina VA, Batyrshin D, Nugmanov RI, Akhmetshin T, Sidorov P, Duybankova N, Verhoeven J, Wegner J, Ceulemans H, Gedich A, Madzhidov TI, Varnek A. Gimadiev TR, et al. Among authors: madzhidov ti. Mol Inform. 2021 Dec;40(12):e2100119. doi: 10.1002/minf.202100119. Epub 2021 Aug 24. Mol Inform. 2021. PMID: 34427989
Hydration of copper(II) amino acids complexes.
Bukharov MS, Shtyrlin VG, Gilyazetdinov EM, Serov NY, Madzhidov TI. Bukharov MS, et al. Among authors: madzhidov ti. J Comput Chem. 2018 May 30;39(14):821-826. doi: 10.1002/jcc.25154. Epub 2017 Dec 28. J Comput Chem. 2018. PMID: 29283453
Atom-to-atom Mapping: A Benchmarking Study of Popular Mapping Algorithms and Consensus Strategies.
Lin A, Dyubankova N, Madzhidov TI, Nugmanov RI, Verhoeven J, Gimadiev TR, Afonina VA, Ibragimova Z, Rakhimbekova A, Sidorov P, Gedich A, Suleymanov R, Mukhametgaleev R, Wegner J, Ceulemans H, Varnek A. Lin A, et al. Among authors: madzhidov ti. Mol Inform. 2022 Apr;41(4):e2100138. doi: 10.1002/minf.202100138. Epub 2021 Nov 2. Mol Inform. 2022. PMID: 34726834 Free article.
35 results