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Titolo Data di pubblicazione Autori Tipo Abstract
Structural determinants of antibiotic translocations in OMPF 2008 KUMAR, AMIT  ; RUGGERONE, PAOLO  ; CECCARELLI, MATTEO   4 Contributo in Atti di Convegno (Proceeding)::4.2 Abstract in Atti di convegno
Molecular simulations reveal the molecular basis of diffusion through porins; and allow designing potent antibiotics 2008 KUMAR, AMIT  ; RUGGERONE, PAOLO  ; CECCARELLI, MATTEO   4 Contributo in Atti di Convegno (Proceeding)::4.2 Abstract in Atti di convegno
Drug design: Insights from atomistic simulations 2009 KUMAR, AMIT  ; VARGIU, ATTILIO VITTORIO  ; CECCARELLI, MATTEO  ; RUGGERONE, PAOLO   4 Contributo in Atti di Convegno (Proceeding)::4.1 Contributo in Atti di convegno
Structural determinants of antibiotic and β-lactamase diffusion through bacterial porins 2009 KUMAR, AMIT  ; RUGGERONE, PAOLO  ; CECCARELLI, MATTEO   4 Contributo in Atti di Convegno (Proceeding)::4.2 Abstract in Atti di convegno
The Biophysics Of Antibiotics Translocation Through OmpF Revealed By Computer Simulations 2009 KUMAR, AMIT  ; RUGGERONE, PAOLO  ; CECCARELLI, MATTEO   4 Contributo in Atti di Convegno (Proceeding)::4.2 Abstract in Atti di convegno
Structural Determinants Of Antibiotic And betalactamase Diffusion Through Bacterial Porins 2009 KUMAR, AMIT  ; RUGGERONE, PAOLO  ; CECCARELLI, MATTEO   1 Contributo su Rivista::1.5 Abstract in rivista -
The Porin passport control-Conductance measurements and biological relevance 2009 KUMAR, AMIT  ; CECCARELLI, MATTEO  ; 1 Contributo su Rivista::1.5 Abstract in rivista -
Molecular simulations reveal the mechanism and the determinants for ampicillin translocation through OmpF 2010 KUMAR, AMIT  ; RUGGERONE, PAOLO  ; CECCARELLI, MATTEO   1 Contributo su Rivista::1.1 Articolo in rivista
Bridging time and length scales: from macroscopic flux to molecular mechanism of antibiotics diffusion through porins 2010 KUMAR, AMIT  ; RUGGERONE, PAOLO  ; CECCARELLI, MATTEO   1 Contributo su Rivista::1.1 Articolo in rivista
Screening for antibiotics with enhanced permeation properties: proof of concept using molecular simulations 2010 KUMAR, AMIT  ; RUGGERONE, PAOLO  ; 1 Contributo su Rivista::1.1 Articolo in rivista -
Structural and dynamical properties of the porins OmpF and OmpC: insights from molecular simulations 2010 KUMAR, AMIT  ; RUGGERONE, PAOLO  ; CECCARELLI, MATTEO   1 Contributo su Rivista::1.1 Articolo in rivista
Molecular Basis of Enrofloxacin Translocation through OmpF, an Outer Membrane Channel of Escherichia coli - When Binding Does Not Imply Translocation 2010 KUMAR, AMIT  ; CECCARELLI, MATTEO   1 Contributo su Rivista::1.1 Articolo in rivista
Towards screening for antibiotics with enhanced permeation properties through bacterial porins 2010 KUMAR, AMIT  ; RUGGERONE, PAOLO  ; CECCARELLI, MATTEO   1 Contributo su Rivista::1.1 Articolo in rivista
Investigating reaction pathways in rare events simulations of antibiotics diffusion through protein channels 2010 KUMAR, AMIT  ; RUGGERONE, PAOLO  ; CECCARELLI, MATTEO   1 Contributo su Rivista::1.1 Articolo in rivista
Molecular basis of enrofloxacin translocation through a bacterial porin – When binding does not imply translocation 2010 KUMAR, AMIT  ; CECCARELLI, MATTEO   1 Contributo su Rivista::1.1 Articolo in rivista
Using Molecular Simulations to Screen for Antibiotics with Enhanced Permeation Properties through Bacterial Pores 2010 KUMAR, AMIT  ; RUGGERONE, PAOLO  ; CECCARELLI, MATTEO   1 Contributo su Rivista::1.5 Abstract in rivista -
Structural and dynamical insights on HLA-DRB1: peptide complexes which confer resistance and susceptibility to multiple sclerosis in sardinia: a molecular dynamics simulation study 2012 KUMAR, AMIT   1 Contributo su Rivista::1.5 Abstract in rivista -
Skeletal Calsequestrin-Calcium Interaction: Role of Acidic C-Terminus 2013 KUMAR, AMIT  ; 1 Contributo su Rivista::1.5 Abstract in rivista -
Combination of classical and molecular modeling approaches to investigate the effect of antipsychotic drugs on cell proliferation kinetics 2013 KUMAR, AMIT  ; CAO, GIACOMO   4 Contributo in Atti di Convegno (Proceeding)::4.1 Contributo in Atti di convegno -
Aromatic interaction profile to understand the molecular basis of raltegravir resistance 2013 KUMAR, AMIT  ; 1 Contributo su Rivista::1.1 Articolo in rivista

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