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Molecular Diversity|April 19, 2007
Prediction of mutagenic toxicity by combination of Recursive Partitioning and Support Vector MachinesQuan Liao, Jianhua Yao, Shengang Yuan
Molecular Diversity|May 25, 2007
A note on the paper entitled "JEDA: joint entropy diversity analysis. An information-theoretic method for choosing diverse and representative subsets from combinatorial libraries" [Melissa R. Landon, Scott E. Schaus, Molecular Diversity (2006) 10 333-339]E Besalú
Molecular Diversity|January 8, 2023
A structure-based virtual high-throughput screening, molecular docking, molecular dynamics and MM/PBSA study identified novel putative drug-like dual inhibitors of trypanosomal cruzain and rhodesain cysteine proteasesChatchakorn Eurtivong, Collin Zimmer, Tanja Schirmeister, et al.
Molecular Diversity|November 27, 2022
Design, synthesis and anticancer activity of 5-((2-(4-bromo/chloro benzoyl) benzofuran-5-yl) methyl)-2-((1-(substituted)-1H-1,2,3-triazol-4-yl)methoxy)benzaldehyde analoguesT Vishnu, M Veerabhadraiah, V Krishna Chaitanya, et al.
Molecular Diversity|November 28, 2022
3D-QSAR assisted identification of selective CYP1B1 inhibitors: an effective bioisosteric replacement/molecular docking/electrostatic complementarity analysisBaddipadige Raju, Bharti Sapra, Om Silakari
Molecular Diversity|December 22, 2022
Pharmacoinformatic approach to identify potential phytochemicals against SARS-CoV-2 spike receptor-binding domain in native and variants of concernRaj Kumar Chinnadurai, Saravanaraman Ponne, Loganathan Chitra, et al.
Molecular Diversity|December 9, 2022
In silico study reveals unconventional interactions between MDC1 of DDR and Beclin-1 of autophagyKavya Pandya, Neeru Singh
Molecular Diversity|November 25, 2019
Modeling antimalarial and antihuman African trypanosomiasis compounds: a ligand- and structure-based approachesJyoti Gahtori, Suyash Pant, Hemant Kumar Srivastava
Molecular Diversity|January 23, 2019
Aroyl and acyl cyanides as orthogonal protecting groups or as building blocks for the synthesis of heterocyclesKamal Usef Sadek, Ramadan Ahmed Mekheimer, Mohamed Abd-Elmonem, et al.
Molecular Diversity|November 7, 2019
Structure elaboration of isoniazid: synthesis, in silico molecular docking and antimycobacterial activity of isoniazid-pyrimidine conjugatesHardeep Kaur, Lovepreet Singh, Kelly Chibale, et al.
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