DI FILIPPO, JUAN I.; SCARDINO, VALERIA; CAVASOTTO, C.N.

¿Qué tan buenos son los modelos de AlphaFold para el cribado virtual basado en docking molecular?

XXIV Simposio Nacional de Química Orgánica

Lugar: Rosario, Santa Fe; Año: 2023;

FERNANDEZ LUNA, A.; SCARDINO, VALERIA; DANA, ALEJANDRO; CAVASOTTO, C.N.; BOLLINI, M.

Desarrollo de antivirales innovadores para el control de enfermedades virales transmitidas por mosquitos: un enfoque local para un desafío global

XXIV Simposio Nacional de Química Orgánica

Lugar: Rosario, Santa Fe; Año: 2023;

CAVASOTTO, CLAUDIO N.

In silico screening for anti-infective drug discovery

31st European Congress of Clinical Microbiology & Infectious Diseases (ECCMID)

Lugar: Viena; Año: 2021;

MAGGINI, JULIÁN; CAVASOTTO, CLAUDIO N.

Reposicionamiento de fármacos para el tratamiento de la infección por COVID 19

LII Reunión Anual de la Asociación Argentina de Farmacología Experimental (AAFE)

Lugar: Córdoba; Año: 2020;

MARTINEZ, F.A.; ADLER, NATALIA S; CAVASOTTO, CLAUDIO N; AUCAR, GUSTAVO A.

Magnetic interactions in small fragments of DNA base pairs

59th Sanibel Symposium

Lugar: St. Simons Island, GA; Año: 2019;

CAVASOTTO, CLAUDIO N

Computational chemistry in drug lead design

XXI CAFQI (Congreso Argentino de Físicoquimica y Química Inorgánica)

Lugar: Tucumán; Año: 2019;

ADLER, NATALIA S; FIDALGO, D.; AMREIN, F.; KAUFMAN, S; ARRAR, M.; BOLLINI, M.; CAVASOTTO, CLAUDIO N

In silico structure-based design of allosteric inhibitors targeting the Dengue virus NS3 helicase

Latin American Workshop in Structural Bioinformatics of Proteins

Lugar: Medellín; Año: 2019;

ARMANDO, N.G.; SZALAI, A.M.; DOS SANTOS CLARO, P.; PIAZZA, V.; SENIN, S.; CAVASOTTO, CLAUDIO N.; ARAMENDÍA, P.F.; SILBERSTEIN, S.

Study of signaling and trafficking of CRH receptors: the use of a new aza-BODIPY fluorescent marker

South American Spring Symposium in Signal Transduction and Molecular Medicine (SISTAM 2018)

Lugar: Bariloche; Año: 2018;

CAVASOTTO, CLAUDIO N.

Molecular Modelling in Rational Drug Design

IX Escola de Modelagem Molecular em Sistemas Biológicos

Lugar: Petropolis, RJ; Año: 2018;

ADLER, NATALIA S.; AUCAR, MARÍA G.; LEAL, EMILSE S.; BATTINI, L.; GEBHARD, LEOPOLDO G.; GAMARNIK, ANDREA V.; BOLLINI, M.; CAVASOTTO, CLAUDIO N.

In silico structure-based design of novel inhibitors targeting the Dengue virus envelope protein E

Frontiers in Bioscience 3

Lugar: Buenos Aires; Año: 2018;

AUCAR, MARÍA G.; ADLER, NATALIA S.; CAVASOTTO, CLAUDIO N.

Small-molecule hydration energy and binding affinity calculations using quantum mechanical approaches

Frontiers in Bioscience 3

Lugar: Buenos Aires; Año: 2018;

ARMANDO, N.G.; SZALAI, A.M.; DOS SANTOS CLARO, P.; SENIN, S.; CAVASOTTO, CLAUDIO N.; ARAMENDÍA, P.F.; SILBERSTEIN, S.

Study of signaling and trafficking of CRH receptors: the use of a new Aza-bodipy fluorescent marker

Frontiers in Bioscience 3

Lugar: Buenos Aires; Año: 2018;

ADLER, NATALIA S; AUCAR, MARÍA G.; LEAL, EMILSE S.; FERNANDEZ, G.A.; BATTINI, L.; BOLLINI, M.; CAVASOTTO, CLAUDIO N

In silico analysis of the interaction of pyrimidine derivatives inhibiting the Dengue virus envelope protein E

Drug Discovery for Neglected Diseases International Congress 2018

Lugar: Buenos Aires; Año: 2018;

ZAMBRANA, ROMINA; CAVASOTTO, CLAUDIO N

Protein flexibility in docking and virtual screening on the beta 2 adrenergic receptor

Drug Discovery for Neglected Diseases International Congress 2018

Lugar: Buenos Aires; Año: 2018;

LEAL, EMILSE S.; FERNANDEZ, G.A.; BATTINI, L.; ADLER, NATALIA S; AUCAR, MARÍA G.; VIDELA, M.; MONGE, MARÍA E.; CAVASOTTO, CLAUDIO N; BOLLINI, M.

Synthesis, biological evaluation and study of in vitro pharmacokinetic properties of antiviral agents against dengue

Drug Discovery for Neglected Diseases International Congress 2018

Lugar: Buenos Aires; Año: 2018;

LEAL, EMILSE S.; AUCAR, MARÍA G.; GEBHARD, LEOPOLDO G.; PASCUAL, MARÍA J.; GAMARNIK, ANDREA V.; CAVASOTTO, CLAUDIO N.; BOLLINI, MARIELA

Dual structure-based approach towards the design of inhibitors of the Dengue virus envelope protein

11th Triennial Congress of the World Association of Theoretical and Computational Chemists

Lugar: Munich; Año: 2017;

CAVASOTTO, CLAUDIO N.

Structure-based design of novel inhibitors targeting the E protein from the Dengue virus

XLII Congress of the Brazilian Biophysics Society

Lugar: Santos, SP; Año: 2017;

CAVASOTTO, CLAUDIO N.

Protein flexibility in docking and homology modelling

FAPESP Drug Discovery Meeting

Lugar: San Carlos; Año: 2017;

SZALAI, A.M.; ARMANDO, N.G.; GIORDANO, L.; BARI, S.E.; INDA, C.; CAVASOTTO, CLAUDIO N.; SILBERSTEIN, S.; ARAMENDÍA, P.F.

New aza-boron-dypyrromethene compound for single molecule fluorescence studies in cells

XIII Encuentro Latinoamericano de Fotoquímica y Fotobiología

Lugar: Carlos Paz, Córdoba; Año: 2017;

SPINOSA, M.; CAVASOTTO, CLAUDIO N.

Modelling the cannabinoid receptor 2 in the agonist- and antagonist-bound conformations

XLII Congress of the Brazilian Biophysics Society (SBBf)

Lugar: Santos (SP); Año: 2017;

LEAL, EMILSE S.; AUCAR, MARÍA G.; GEBHARD, LEOPOLDO G.; IGLESIAS, NESTOR G.; PASCUAL, MARÍA J.; CASAL, JUAN J.; GAMARNIK, ANDREA V.; CAVASOTTO, CLAUDIO N.; BOLLINI, MARIELA

Classical and quantum mechanical simulations exploring the interaction between entry inhibitors and protein E of dengue virus

XLII Congress of the Brazilian Biophysics Society (SBBf)

Año: 2017;

BOLLINI, MARIELA; LEAL, EMILSE S.; ADLER, NATALIA S.; AUCAR, MARÍA G.; PASCUAL, MARÍA J.; FERNANDEZ, G.A.; MERWAISS, F.; ALVAREZ, DIEGO E.; CAVASOTTO, CLAUDIO N.

Small-molecule docking, Molecular Dynamics, and classical and quantum mechanics binding free energy calculation to identify novel bovine viral diarrhea envelope protein inhibitors

XLII Congress of the Brazilian Biophysics Society (SBBf)

Lugar: Santos (SP); Año: 2017;

LEAL, EMILSE S.; BATTINI, L.; PASCUAL, MARÍA J.; GUREVICH MESSINA, J.M.; MONGE, MARÍA E.; CAVASOTTO, CLAUDIO N.; ALVAREZ, DIEGO E.; BOLLINI, MARIELA

Identificación de pequeñas moléculas inhibidoras de la entrada del virus de la diarrea viral bovina a través del diseño guiado por computadora

XXI Simposio Nacional de Química Orgánica

Lugar: Potrero de los Funes, San Luis; Año: 2017;

LEAL, EMILSE S.; AUCAR, MARÍA G.; FERNANDEZ, G.A.; CAVASOTTO, CLAUDIO N.; BOLLINI, MARIELA

Identificación de nuevos inhibidores de la entrada del virus de Dengue a través de un enfoque basado en la estructura

XXI Simposio Nacional de Química Orgánica

Lugar: Potrero de los Funes, San Luis; Año: 2017;

LEAL, EMILSE S.; IGLESIAS, NESTOR G.; AUCAR, MARÍA G.; GEBHARD, LEOPOLDO G.; CASAL, JUAN J.; VALDEZ, DAMIÁN; GAMARNIK, ANDREA V.; CAVASOTTO, CLAUDIO N.; BOLLINI, MARIELA

Identification of Small-molecules Dengue Virus Entry Inhibitor

Frontiers in Bioscience 2

Año: 2016;

SZALAI, A.M.; GIORDANO, L.; BARI, S.E.; SILBERSTEIN, S.; CAVASOTTO, CLAUDIO N.; ARAMENDÍA, P.F.

New aza-boron-dipyrromethene compounds for single molecule fluorescence studies

25th Inter-American Photochemical Society Meeting

Lugar: Santiago; Año: 2016;

CAVASOTTO, CLAUDIO N.; SPINOSA, M.; AUCAR, MARÍA G.; DIAZ, PHILIPPE

Modelling the Cannabinoid 2 Receptor and Structure Based Studies of Agonist/antagonist Molecular Switches

33rd Camerino-Cyprus Symposium "Receptor Chemistry: Reality and Vision"

Lugar: Camerino; Año: 2016;

SZALAI, A.M.; GIORDANO, L.; BARI, S.E.; SILBERSTEIN, S.; CAVASOTTO, CLAUDIO N.; ARAMENDÍA, P.F.

Aza-bodipys asimétricos como marcadores en el estudio de receptores proteicos

XXI Simposio Nacional de Química Orgánica

Lugar: Mar del Plata; Año: 2015;

LAZZARO, L; RISK, M; CAVASOTTO, CLAUDIO N.

Algorithmic development for the design of ligand and un-biased decoy databases for protein-ligand docking

XX Congreso de Bioingeniería

Año: 2015;

AUCAR, MARÍA G.; LAVECCHIA, M; CAVASOTTO, CLAUDIO N.

Optimización de los parámetros atómicos para el modelo de solvente continuo COSMO

XXI Reunión de Comunicaciones Científicas y Tecnológicas

Lugar: Resistencia; Año: 2015;

CAVASOTTO, CLAUDIO N.

Bridging QM/QM calculations and molecular dynamics in biomolecular systems

Latin American Conference on Mathematial Modeling of Biological Systems

Año: 2015;

CAVASOTTO, CLAUDIO N.

Computational Chemistry and Drug Design

III Encuentro de docentes de farmacología de facultades de odontología de universidades de gestión pública de la República Argentina

Lugar: CABA; Año: 2015;

CAVASOTTO, CLAUDIO N.

Computational Chemistry and Drug Design

1st South American PIs Workshop in Molecular Simulation

Lugar: Montevideo; Año: 2015;

CAVASOTTO, CLAUDIO N.

Computational Chemistry and Drug Design

III Encuentro de docentes de farmacología de facultades de odontología de universidades de gestión pública de la República Argentina

Año: 2015;

ROSSI, M.; ROTBLAT, B.; ANSELL, K.; CAVASOTTO, CLAUDIO N.; CIECHANOVER, A.; MELINO, G.

Identification and characterization of inhibitors of HECT E3 ligases by high throughput screening

Seventh International Conference SUMO, Ubiquitin, UBL Proteins: Implications for Human Diseases

Lugar: Shanghai; Año: 2014;

ROSSI, M.; ROTBLAT, B.; ANSELL, K.; CAVASOTTO, CLAUDIO N.; CIECHANOVER, A.; MELINO, G.

IDENTIFICATION AND CHARACTERIZATION OF INHIBITORS OF HECT E3 LIGASES BY HIGH THROUGHPUT SCREENING

SAIB 50th Annual Meeting

Lugar: Rosario; Año: 2014;

LAVECCHIA, M; PUIG DE LA BELLACASA R.; BORRELL, J.I.; CAVASOTTO, CLAUDIO N.

In Silico Optimization of Epidermal Growth Factor Receptor Inhibitors Followed by Experimental Evaluation

V Argentinian Conference on Bioinformatics and Computational Biology

Año: 2014;

CAVASOTTO, CLAUDIO N.

Incorporating quantum-mechanical methods in structure-based drug discovery

BrazMedChem 2014

Lugar: Campos do Jordao-SP; Año: 2014;

BRAND, C.S.; HOCKER, H.J.; GORFE, A.A.; CAVASOTTO, CLAUDIO N.; DESSAUER, C.W.

Isoform Selectivity of Adenylyl Cyclase Inhibitors and Identification of Novel Compounds

Experimental Biology 2013

Lugar: Boston, MA; Año: 2013;

KIRESTIAN, C.D.; ACOSTA, F.S.; LAZARO MARTÍNEZ, J.M.; CAVASOTTO, CLAUDIO N.; BOLLINI, M.

Identificación de potenciales inhibidores de la entrada del virus de dengue mediante screening virtual

XIX Simposio Nacional de Química Orgánica

Lugar: Mar del Plata; Año: 2013;

CAVASOTTO, CLAUDIO N.

Design of Ligand and Small-Molecule Decoy Libraries for Docking to G Protein-Coupled Receptors

4to. Congreso Argentino de Bioinformática y Biología Computacional (4CAB2C) y 4ta. Conferencia Internacional de la Sociedad Iberoamericana de Bioinformática (SolBio)

Lugar: Rosario; Año: 2013;

CAVASOTTO, CLAUDIO N.

Computer-aided structure based drug discovery in GPCRs

6th Brazilian Symposium on Medicinal Chemistry

Lugar: Canela-RS; Año: 2012;

CAVASOTTO, CLAUDIO N.

In silico characterization of molecular interactions in biological systems

3er. Congreso Argentino de Bioinformática y Biología Computacional

Lugar: Oro Verde, Entre Ríos; Año: 2012;

CAVASOTTO, CLAUDIO N.

In silico characterization of molecular interactions in biological systems.

"Frontiers in BioScience" - A joint symposium of the Max Planck Society and the Polo Cientifico

Lugar: Buenos Aires; Año: 2012;

NEIRA, JOSE L.; DOMENECH, R.; BOCANEGRA, R.; ABIÁN, OLGA; CORREA, J.; SOUSA-HERVÉS, A.; BUENO, MARTA; VELÁZQUEZ-CAMPOY, ADRIÁN; CAVASOTTO, CLAUDIO N.; RIGUERA, R.; SANCHO, JAVIER; FERNÁNDEZ, E.; MATEU, MAURICIO G.

Designing inhibitors against the capsid protein of HIV-1

V National Conference BIFI 2011

Lugar: Zaragoza; Año: 2011;

PETROV, R.R.; ASTRUC-DIAZ, FANNY; CAVASOTTO, CLAUDIO N.; DIAZ, PHILIPPE

Novel series of cannabinoid modulators for thetreatment of obesity associated disorders

241st Meeting of the American Chemical Society

Lugar: Anaheim, CA; Año: 2011;

PETROV, R.R.; ASTRUC-DIAZ, FANNY; CAVASOTTO, CLAUDIO N.; DIAZ, PHILIPPE

Novel series of CB2 selective agonists for the treatment of neuropathic pain

241st Meeting of the American Chemical Society

Lugar: Anaheim, CA; Año: 2011;

BRAND, C.; MALIK, S.; SRMCKA, A.V.; CAVASOTTO, CLAUDIO N.; DESSAUER, C.W.

Targeting of Adenylyl Cyclase for Inhibition by Peptides and Novel Small Molecule Inhibitors

21st Keck Annual Research Conference

Lugar: Houston, TX; Año: 2011;

CAVASOTTO, CLAUDIO N.

Ligand-steered homology modelling and high-throughput docking: Successful evaluation in GPCRs

New trends in Computational Chemistry for Industry Application

Lugar: Barcelona; Año: 2011;

PETROV, R.R.; PHATAK, SHARANGDHAR S; ASTRUC-DIAZ, FANNY; CAVASOTTO, CLAUDIO N.; DIAZ, PHILIPPE

Novel series of CB2 selective antagonists for the treatment of autoimmune disorders: Synthesis, functional evaluation and ligand-steered modeling

240th National Meeting of the American-Chemical-Society

Lugar: Boston, MA; Año: 2010;

COSTANZI, STEFANO; VILAR, SANTIAGO; FERINO, GIULIO; PHATAK, SHARANGDHAR S; BERK, BARKIN; CAVASOTTO, CLAUDIO N.

Assessment and optimization of docking-based virtual screening for GPCR ligands: not only crystal structures but also homology models

240th National Meeting of the American-Chemical-Society

Lugar: BOS; Año: 2010;

CAVASOTTO, CLAUDIO N.; PHATAK, SHARANGDHAR S

High-quality ligand-steered modeling and docking evaluation of class A G protein-coupled receptors

240th National Meeting of the American-Chemical-Society

Lugar: Boston, MA; Año: 2010;

DASGUPTA, I,; SRIVASTAVA, M.; TANIFUM, E.A.; PHATAK, SHARANGDHAR S.; CAVASOTTO, CLAUDIO N.; ANNAPRAGADA, ANANTH

Boronic Acid Based Microparticulate Insulin Delivery System

Annual Meeting of the Biomedical Engineering Society

Lugar: Austin, TX; Año: 2010;

PHATAK, SHARANGDHAR S; DIAZ, PHILIPPE; XU, J.; DIAZ, FANNY-ASTRUC; NAGUIB, MOHAMMED; CAVASOTTO, CLAUDIO N.

Ligand-steered Modeling of the Cannabinoid Receptor 2: Successful Applications to Rationalize SAR Data of Selective CB2 Inverse Agonist and Agonist Compounds

15th Annual Structural Biology Symposium

Lugar: Galveston, TX; Año: 2010;

COSTANZI, STEFANO; FERINO, GIULIO; VILAR, SANTIAGO; BERK, BARKIN; ENGEL, S.; TIKHONOVA, IRINA; GERSHENGORN, M.C.; HARDEN, T.K.; JACOBSON, K.A.; CAVASOTTO, CLAUDIO N.

Identification of GPCR Ligands through Docking-based Virtual Screening: Not only Crystal Structures but also Homology Models

28th Camerino-Cyprus-Noordwijkerhout Symposium ?Trekking through Receptor Chemistry?

Lugar: Camerino; Año: 2010;

ECHENIQUE, PABLO; CAVASOTTO, CLAUDIO N.; GARCÍA-RISUEÑO, PABLO; ALONSO, JOSÉ L.

The canonical equilibrium of constrained molecular models

Constraints in Molecular Simulation

Lugar: Zaragoza; Año: 2010;

PHATAK, SHARANGDHAR S; DIAZ, PHILIPPE; XU, J.; ASTRUC-DIAZ, FANNY; NAGUIB, MOHAMMED; CAVASOTTO, CLAUDIO N.

Ligand-steered modeling of the cannabinoid receptor 2: Successful applications to rationalize SAR data of selective CB2 inverse agonist and agonist compounds

240th National Meeting of the American-Chemical-Society

Lugar: Boston, MA; Año: 2010;

CAVASOTTO, CLAUDIO N.; PHATAK, SHARANGDHAR S

Ligand-steered homology modeling and high-throughput docking: Successful evaluation in GPCRs

240th Meeting of the American Chemical Society

Lugar: Boston, MA; Año: 2010;

CAVASOTTO, CLAUDIO N.; ANISIMOV, VICTOR M.

Study of Charge Transfer in Ubiquitin in Aqueous Solution

XXVth Anniversary of the Theoretical Chemistry Network in Catalunya

Lugar: Barcelona; Año: 2009;

GATICA, EDGAR A.; CAVASOTTO, CLAUDIO N.

Validation of Novel in silico Methodologies

Annual Biomedical Research Conference for Minority Students

Lugar: Phoenix, AZ; Año: 2009;

BOCANEGRA, R.; RODRIGUEZ-HUETE, A.; FUERTES, M.A.; CAVASOTTO, CLAUDIO N.; NEIRA, JOSE L.; MATEU, MAURICIO G.

In vitro inhibition of the immunodeficiency virus by a peptide which mimics the dimerization interface

10th National Meeting of Virology

Lugar: Salamanca; Año: 2009;

PHATAK, SHARANGDHAR S; DIAZ, PHILIPPE; XU, J.; ASTRUC-DIAZ, FANNY; NAGUIB, MOHAMMED; CAVASOTTO, CLAUDIO N.

Ligand-steered Modeling of the Cannabinoid Receptor 2: Successful Applications to Rationalize SAR Data of Selective CB2 Inverse Agonist and Agonist Compounds

19th Keck Center Annual Research Conference "Computation in Biology: from Gene to Neuron"

Lugar: Houston, TX; Año: 2009;

ANISIMOV, VICTOR M.; CAVASOTTO, CLAUDIO N.

QM method development for structure-based drug design

238th National Meeting of the American-Chemical-Society

Lugar: Washington, DC; Año: 2009;

ANISIMOV, VICTOR M.; BUGAENKO, V.L.; CAVASOTTO, CLAUDIO N.

Quantum-mechanical simulation of biological macromolecules and its application in structure-based drug design

238th National Meeting of the American-Chemical-Society

Lugar: Washington, DC; Año: 2009;

GATICA, EDGAR A.; CAVASOTTO, CLAUDIO N.

Incorporating Protein Flexibility in Virtual Screening

Annual Biomedical Research Conference for Minority Students

Lugar: Orlando, FL; Año: 2008;

GATICA, EDGAR A.; CAVASOTTO, CLAUDIO N.

Incorporating Protein Flexibility in Virtual Screening

Graduate School and Internship Fair

Lugar: Houston, TX; Año: 2008;

CAVASOTTO, CLAUDIO N.

High-throughput docking in Drug Discovery

Workshop on High Throughput Screening Large Scale Data Set

Lugar: Houston, TX; Año: 2008;

CAVASOTTO, CLAUDIO N.

Coupling ligand-steered homology modeling and structure-based virtual screening: Discovery of novel antagonist chemotypes to the melanin concentrating hormone receptor, a class A GPCR

236th Meeting of the American Chemical Society

Lugar: Philadelphia, PA; Año: 2008;

CAVASOTTO, CLAUDIO N.

Novel Chemotypes to Melanin-Concentrating Hormone Receptor 1 Discovered Through Ligand-Steered Homology Modeling and Virtual Screening

Drug Discovery Chemistry

Lugar: San Diego, CA; Año: 2008;

CAVASOTTO, CLAUDIO N.

Ligand and structure based screening

Workshop on High Throughput / High Content Screening and its application to Target-based Drug Discovery Research

Lugar: Houston, TX; Año: 2007;

CAVASOTTO, CLAUDIO N.

Physics and Computers in the Aid of Drug Discovery

Keck Annual Research Conference

Lugar: League City, TX; Año: 2007;

BISSON, WILLIAM H.; ABAGYAN, RUBEN A.; CAVASOTTO, CLAUDIO N.

Role of point mutations causing antiandrogen withdrawal syndrome studied by molecular simulations and computational prediction approacheS

231st National Meeting of the American-Chemical-Society

Lugar: ATLANTA, GA; Año: 2006;

MONTI, MARIA C.; CAVASOTTO, CLAUDIO N.; TOSCO, A.; DAL PIAZ, F.; LEONE, A.; CASAPULLO, A.; RICCIO, R.; ABAGYAN, RUBEN A.; GOMEZ-PALOMA, LUIGI

Inhibition of human group IIA Phospholipase A2 by Petrosaspongiolide M through a mechanism of protein-protein trans-inactivation

231st National Meeting of the American-Chemical-Society

Lugar: ATLANTA, GA; Año: 2006;

ORRY, ANDREW J.; CAVASOTTO, CLAUDIO N.

Ligand-docking-based homology model of the melanin-concentrating hormone 1 receptor

231st National Meeting of the American-Chemical-Society

Lugar: Washington, DC; Año: 2006;

CAVASOTTO, CLAUDIO N.; ORTIZ, MARÍA A.; ABAGYAN, RUBEN A.; CAVASOTTO, CLAUDIO N.

In silico identification of novel chemical scaffolds as inhibitors of EGFR tyrosine kinase activity

231st National Meeting of the American-Chemical-Society

Lugar: Washington, DC; Año: 2006;

CAVASOTTO, CLAUDIO N.

Docking and Virtual Screening to Protein Kinases

Fourth Annual Conference on Protein Kinase Targets, Cambridge Healthtech Institute

Lugar: Boston, MA; Año: 2006;

CAVASOTTO, CLAUDIO N.

Ligand docking and virtual screening in structure-based drug discovery

BIFI 2006 - II International Conference: From Physics to Biology: the interface between experiment and computation

Lugar: Zaragoza; Año: 2006;

BISSON, WILLIAM H.; CAVASOTTO, CLAUDIO N.; ABAGYAN, RUBEN A.

The role of point mutations causing antiandrogen withdrawal syndrome studied by molecular simulations and computational prediction approaches

MipTec

Lugar: Basel; Año: 2005;

KOVACS, JULIO A.; CAVASOTTO, CLAUDIO N.; ABAGYAN, RUBEN A.

Receptor conformational sampling through normal mode analysis and its application to virtual screening

49th Annual Meeting of the Biopysical-Society

Lugar: Long Beach, CA; Año: 2005;

ABAGYAN, RUBEN A.; AN, JIANHONG; CAVASOTTO, CLAUDIO N.; FERNANDEZ-RECIO, JUAN; KUFAREVA, I.; TOTROV, MAXIM

Predicting Molecular Association

Albany 2005. The 14th Conversation

Lugar: Albany, NY; Año: 2005;

CAVASOTTO, CLAUDIO N.; KOVACS, JULIO A.; TOTROV, MAXIM; ABAGYAN, RUBEN A.

Incorporating receptor flexibility in ligand docking and virtual screening through a normal made analysis-based procedure

48th Annual Meeting of the Biophysical Society

Lugar: Bethesda, MD; Año: 2004;

ABAGYAN, RUBEN A.; TOTROV, MAXIM; FERNANDEZ-RECIO, JUAN; KOVACS, JULIO A.; CAVASOTTO, CLAUDIO N.

Simulating induced fit in molecular docking

CECAM Workshop on Flexible Macromolecular Docking

Lugar: Lyon; Año: 2004;

CAVASOTTO, CLAUDIO N.

Structure-based development of drug target-specific compound libraries

IBC 2nd Annual Target-Based Compound Libraries Meeting

Lugar: San Diego, CA; Año: 2004;

ABAGYAN, RUBEN A.; BORDNER, ANDREW J.; CAVASOTTO, CLAUDIO N.; TOTROV, MAXIM

Accurate electrostatic calculations for transfer energies and conformational sampling

225th National Meeting of the American-Chemical-Society

Lugar: New Orleans, LA; Año: 2003;

GIRIBET, CLAUDIA G.; RUIZ DE AZUA, M.C.; VIZIOLI, CELIA V.; CAVASOTTO, CLAUDIO N.

Acoplamientos intermoleculares en sistemas con puentes de hidrógeno

88 Reunión de la Asociación Física Argentina

Lugar: Bariloche; Año: 2003;

CAVASOTTO, CLAUDIO N.; TOTROV, MAXIM; ABAGYAN, RUBEN A.

Protein kinases as targets for virtual ligand screening

225th National Meeting of the American-Chemical-Society

Lugar: New Orleans, LA; Año: 2003;

DAWSON, M.I.; CAVASOTTO, CLAUDIO N.; JONG, L.; FENG, K.-C.; LEID, M.; LI, H.; ABAGYAN, RUBEN A.; ZHANG, X.-K.

Synthesis and biological activity of retinoid antagonist selective for the retinoid X receptor (RXR)

AACR Annual Meeting

Lugar: San Francisco, CA; Año: 2002;

ORRY, ANDREW J.; CAVASOTTO, CLAUDIO N.; ABAGYAN, RUBEN A.

Rational structure-based design of anti-breast-cancer drugs targeting the ErbB family of receptor tyrosine kinases

Era of Hope - DOD Breast Cancer Research Program

Lugar: Orlando, FL; Año: 2002;

CAVASOTTO, CLAUDIO N.; ABAGYAN, RUBEN A.

Flexible receptor model explains structural determinants for agonist and antagonist activity in retinoid receptors

Era of Hope Meeting - DOD Breast Cancer Program

Lugar: Orlando, FL; Año: 2002;

VIZIOLI, CELIA V.; CAVASOTTO, CLAUDIO N.; RUIZ DE AZUA, M.C.

New fast extrinsic localization method for occupied molecular orbitals

83 Reunión de la Asociación Física Argentina

Lugar: La Plata; Año: 1998;

CAVASOTTO, CLAUDIO N.; GRINBERG, HORACIO

A Liouville space-based method for the decoupling of the equation of motion of the polarization propagator

82 Reunión de la Asociación Física Argentina

Lugar: San Luis; Año: 1997;

CAVASOTTO, CLAUDIO N.; GRINBERG, HORACIO

An ansatz for the decoupling of the equation of motion of the polarization propagator

81 Reunión de la Asociación Física Argentina

Lugar: Tandil; Año: 1996;

CAVASOTTO, CLAUDIO N.; GRINBERG, HORACIO

Self-energy of the polarization propagator for a Hartree-Fock reference state

79 Reunión de la Asociación Física Argentina

Lugar: Villa Giardino; Año: 1994;