D-Index & Metrics Best Publications

D-Index & Metrics D-index (Discipline H-index) only includes papers and citation values for an examined discipline in contrast to General H-index which accounts for publications across all disciplines.

Discipline name D-index D-index (Discipline H-index) only includes papers and citation values for an examined discipline in contrast to General H-index which accounts for publications across all disciplines. Citations Publications World Ranking National Ranking
Chemistry D-index 70 Citations 16,066 301 World Ranking 2582 National Ranking 53

Overview

What is she best known for?

The fields of study she is best known for:

  • Enzyme
  • Gene
  • Organic chemistry

Her primary scientific interests are in Drug discovery, Stereochemistry, Acetylcholinesterase, Binding site and Biochemistry. Her work carried out in the field of Drug discovery brings together such families of science as Multi target, Computational biology and Drug. Her Stereochemistry research incorporates elements of Molecule, Structure–activity relationship, Chemical synthesis, Peptide and Amyloid.

Her Acetylcholinesterase research incorporates themes from Alzheimer's disease, Neurotoxicity, Acridine and Enzyme inhibitor. Her Binding site study combines topics in areas such as Plasma protein binding, Bioavailability and Ligand. Her studies deal with areas such as QT interval, Ligand and Molecular dynamics as well as Bioinformatics.

Her most cited work include:

  • Multi-Target-Directed Ligands To Combat Neurodegenerative Diseases (749 citations)
  • Role of Molecular Dynamics and Related Methods in Drug Discovery. (337 citations)
  • Role of Molecular Dynamics and Related Methods in Drug Discovery. (337 citations)

What are the main themes of her work throughout her whole career to date?

Andrea Cavalli mainly investigates Drug discovery, Stereochemistry, Biochemistry, Molecular dynamics and Pharmacology. Her biological study spans a wide range of topics, including Virtual screening, Docking, In silico and Computational biology. Her study in Stereochemistry is interdisciplinary in nature, drawing from both Acetylcholinesterase, Active site, Lead compound, Structure–activity relationship and Chemical synthesis.

Her Acetylcholinesterase course of study focuses on Enzyme inhibitor and Molecular model. In her research, Plasma protein binding and Metadynamics is intimately related to Ligand, which falls under the overarching field of Molecular dynamics. Her Pharmacology research is multidisciplinary, incorporating elements of Memantine, Galantamine and Disease.

She most often published in these fields:

  • Drug discovery (40.00%)
  • Stereochemistry (28.86%)
  • Biochemistry (23.80%)

What were the highlights of her more recent work (between 2018-2021)?

  • Drug discovery (40.00%)
  • Molecular dynamics (26.33%)
  • Pharmacology (24.30%)

In recent papers she was focusing on the following fields of study:

Her main research concerns Drug discovery, Molecular dynamics, Pharmacology, Biophysics and Homologous recombination. Her work deals with themes such as Surface plasmon resonance, Metadynamics and Rational design, which intersect with Drug discovery. Her study looks at the relationship between Molecular dynamics and fields such as Extracellular, as well as how they intersect with chemical problems.

Her Pharmacology research includes elements of In vitro, Fluoxetine and Sertraline. Her Biophysics study incorporates themes from Redox, Tissue damage, HMGB1 and Oxidation state. She interconnects Allosteric regulation, Small molecule and Binding site in the investigation of issues within Computational biology.

Between 2018 and 2021, her most popular works were:

  • Kinetics of Drug Binding and Residence Time (23 citations)
  • Kinetics of Drug Binding and Residence Time (23 citations)
  • Predicting Residence Time and Drug Unbinding Pathway through Scaled Molecular Dynamics. (20 citations)

In her most recent research, the most cited papers focused on:

  • Enzyme
  • Gene
  • Organic chemistry

Drug discovery, Molecular dynamics, Metadynamics, Synthetic lethality and Pancreatic cancer are her primary areas of study. Her Drug discovery study combines topics from a wide range of disciplines, such as Molecular simulation, Drug target and Biochemical engineering. The study incorporates disciplines such as Chemical physics, Biological system and Dimensionality reduction in addition to Molecular dynamics.

The Metadynamics study combines topics in areas such as Statistical physics, Markov chain and Complement. The concepts of her Synthetic lethality study are interwoven with issues in Cancer research, Olaparib, RAD51, Homologous recombination and Ovarian cancer. Her Pancreatic cancer research is multidisciplinary, relying on both Synthetic Lethal Mutations, PARP inhibitor, DNA and Poly Polymerase Inhibitor.

This overview was generated by a machine learning system which analysed the scientist’s body of work. If you have any feedback, you can contact us here.

Best Publications

Multi-Target-Directed Ligands To Combat Neurodegenerative Diseases

Andrea Cavalli;Maria Laura Bolognesi;Anna Minarini;Michela Rosini.
Journal of Medicinal Chemistry (2008)

1021 Citations

Role of Molecular Dynamics and Related Methods in Drug Discovery.

Marco De Vivo;Marco De Vivo;Matteo Masetti;Giovanni Bottegoni;Andrea Cavalli;Andrea Cavalli.
Journal of Medicinal Chemistry (2016)

477 Citations

Toward a pharmacophore for drugs inducing the long QT syndrome: insights from a CoMFA study of HERG K(+) channel blockers.

Andrea Cavalli;Elisabetta Poluzzi;Fabrizio De Ponti;Maurizio Recanatini.
Journal of Medicinal Chemistry (2002)

421 Citations

Safety of non-antiarrhythmic drugs that prolong the QT interval or induce torsade de pointes: an overview.

Fabrizio De Ponti;Elisabetta Poluzzi;Andrea Cavalli;Maurizio Recanatini.
Drug Safety (2002)

364 Citations

Insight Into the Kinetic of Amyloid β (1–42) Peptide Self‐Aggregation: Elucidation of Inhibitors’ Mechanism of Action

Manuela Bartolini;Carlo Bertucci;Maria Laura Bolognesi;Andrea Cavalli.
ChemBioChem (2007)

359 Citations

QT prolongation through hERG K(+) channel blockade: current knowledge and strategies for the early prediction during drug development.

Maurizio Recanatini;Elisabetta Poluzzi;Matteo Masetti;Andrea Cavalli.
Medicinal Research Reviews (2005)

280 Citations

Multi-target-directed drug design strategy: from a dual binding site acetylcholinesterase inhibitor to a trifunctional compound against Alzheimer's disease.

Maria Laura Bolognesi;Andrea Cavalli;Luca Valgimigli;Manuela Bartolini.
Journal of Medicinal Chemistry (2007)

278 Citations

Neglected tropical diseases: multi-target-directed ligands in the search for novel lead candidates against Trypanosoma and Leishmania.

Andrea Cavalli;Maria Laura Bolognesi.
Journal of Medicinal Chemistry (2009)

249 Citations

Multi-target-directed coumarin derivatives: hAChE and BACE1 inhibitors as potential anti-Alzheimer compounds.

Lorna Piazzi;Andrea Cavalli;Francesco Colizzi;Federica Belluti.
Bioorganic & Medicinal Chemistry Letters (2008)

237 Citations

Inhibition of Acetylcholinesterase, β-Amyloid Aggregation, and NMDA Receptors in Alzheimer’s Disease: A Promising Direction for the Multi-target-Directed Ligands Gold Rush

Michela Rosini;Elena Simoni;Manuela Bartolini;Andrea Cavalli.
Journal of Medicinal Chemistry (2008)

215 Citations

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