Adrián Kalászi

Most-cited papers

1. Screen3D: A Novel Fully Flexible High-Throughput Shape-Similarity Search Method

   Adrián Kalászi, Dániel Szisz, G. Imre, Tímea Polgár

   2014Journal of Chemical Information and Modeling36 citations

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2. Synthesis, conformation, and immunoreactivity of new carrier molecules based on repeated tuftsin‐like sequence

   G. Mezö, Adrián Kalászi, J. Reményi, Z. Majer +6 more

   2004Biopolymers35 citations

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3. Generation and analysis of the conformational potential energy surfaces of N-acetyl-N-methyl-l-alanine-N′-methylamide. An exploratory ab initio study

   I. Bágyi, B. Balogh, A. Czajlik, O. Éliás +21 more

   200312 citations

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4. Antibody recognition and conformational flexibility of a plaque-specific beta-amyloid epitope modulated by non-native peptide flanking regions.

   M. Manea, Adrián Kalászi, G. Mező, K. Horváti +6 more

   2008Journal of Medicinal Chemistry9 citations Open access

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5. Advanced Automatic Generation of 3 D Molecular Structures

   G. Imre, Adrián Kalászi, I. Jákli, Ö. Farkas

   9 citations

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6. Lead conformer prediction based on a library of flexible molecules

   Adrián Kalászi, Ö. Farkas

   20037 citations

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7. Identifying new topoisomerase II poison scaffolds by combining publicly available toxicity data and 2D/3D-based virtual screening

   A. Lovrics, Veronika F. S. Pape, Dániel Szisz, Adrián Kalászi +3 more

   2019Journal of Cheminformatics6 citations Open access

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8. Screen 3D: A ligand-based 3D similarity search without conformational sampling

   W. David, Adrián Kalászi

   20133 citations Open access

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9. Identification of the bioactive conformation for mucin epitope peptides

   Adrián Kalászi, G. Imre, I. Jákli, Ö. Farkas

   20073 citations

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10. Parameter-free linear relationship (PFLR) and its application to 3D QSAR

    Ö. Farkas, I. Jákli, Adrián Kalászi, G. Imre

    20091 citations

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11. Flexible alignment in 3D and its applications

    Adrián Kalászi, G. Imre, Miklós Vargyas

    2011Journal of Cheminformatics0 citations Open access

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