Wely B. Floriano

发表

A cluster-aware graphical user interface for a virtual ligand screening tool

Amar Raheja, Zachary H. Ramjan, Wely B. Floriano, 2008, 2008 30th Annual International Conference of the IEEE Engineering in Medicine and Biology Society.

Creating and virtually screening databases of fluorescently-labelled compounds for the discovery of target-specific molecular probes

Wely B. Floriano, Rhiannon L. Kamstra, Saedeh Dadgar, 2014, Journal of Computer-Aided Molecular Design.

Molecular Dynamics of Fibrinogen Adsorption onto Graphene, but Not onto Poly(ethylene glycol) Surface, Increases Exposure of Recognition Sites That Trigger Immune Response

Wely B. Floriano, Oleg Rubel, Nadiya Dragneva, 2016, J. Chem. Inf. Model..

Principal Component Analysis of Binding Energies for Single-Point Mutants of hT2R16 Bound to an Agonist Correlate with Experimental Mutant Cell Response

Darryl L. Willick, Wely B. Floriano, Derek E. Chen, 2015, J. Comput. Biol..

Strategies for multiscale modeling and simulation of organic materials: polymers and biopolymers

William A. Goddard, Tahir Cagin, Siddharth Dasgupta, 2001 .

Modeling the human PTC bitter-taste receptor interactions with bitter tastants

Nagarajan Vaidehi, Wely B. Floriano, Dennis Drayna, 2006, Journal of molecular modeling.

Fidelity of Phenylalanyl-tRNA Synthetase in Binding the Natural Amino Acids

William A. Goddard, Peter M. Kekenes-Huskey, Nagarajan Vaidehi, 2003 .

Predicted 3 D structure for the human 2 adrenergic receptor and its binding site for agonists and antagonists

William A. Goddard, Peter L. Freddolino, Nagarajan Vaidehi, 2004 .

Sweet taste receptor gene variation and aspartame taste in primates and other species.

Wely B. Floriano, J. Brand, G. Beauchamp, 2011, Chemical senses.

N‐(2,4)‐dinitrophenyl‐L‐arginine Interacts with EphB4 and Functions as an EphB4 Kinase Modulator

Wely B. Floriano, A. Freywald, W. Floriano, 2015, Chemical Biology and Drug Design.

Prediction of structure and function of G protein-coupled receptors

Peter L. Freddolino, Nagarajan Vaidehi, Wely B. Floriano, 2002, Proceedings of the National Academy of Sciences of the United States of America.

Test of the Binding Threshold Hypothesis for olfactory receptors: Explanation of the differential binding of ketones to the mouse and human orthologs of olfactory receptor 912‐93

Nagarajan Vaidehi, Wely B. Floriano, William A Goddard, 2005, Protein science : a publication of the Protein Society.

Predicted 3-D structures for mouse I7 and rat I7 olfactory receptors and comparison of predicted odor recognition profiles with experiment.

Nagarajan Vaidehi, Wely B. Floriano, William A Goddard, 2004, Chemical senses.

Making sense of olfaction through predictions of the 3-D structure and function of olfactory receptors.

Nagarajan Vaidehi, Wely B. Floriano, William A Goddard, 2004, Chemical senses.

Molecular mechanisms underlying differential odor responses of a mouse olfactory receptor.

G M Shepherd, Wely B. Floriano, N Vaidehi, 2000, Proceedings of the National Academy of Sciences of the United States of America.

Concussion Diagnostics: A New Diagnostic Approach Using PET Technology

Wely B. Floriano, Michael Campbell, Jessica Allingham, 2023, SN Computer Science.

Genetic diversity in the IZUMO1-JUNO protein-receptor pair involved in human reproduction

Wely B. Floriano, W. Floriano, Jessica Allingham, 2021, bioRxiv.

The MPSim‐Dock hierarchical docking algorithm: Application to the eight trypsin inhibitor cocrystals

William A. Goddard, Art E. Cho, Peter M. Kekenes-Huskey, 2005, J. Comput. Chem..

HierVLS hierarchical docking protocol for virtual ligand screening of large-molecule databases.

Nagarajan Vaidehi, Wely B. Floriano, William A Goddard, 2004, Journal of medicinal chemistry.

Predicted 3D structure for the human beta 2 adrenergic receptor and its binding site for agonists and antagonists.

Peter L. Freddolino, Nagarajan Vaidehi, Wely B. Floriano, 2004, Proceedings of the National Academy of Sciences of the United States of America.

Predictions of CCR1 Chemokine Receptor Structure and BX 471 Antagonist Binding Followed by Experimental Validation*

Ravinder Abrol, Nagarajan Vaidehi, Wely B. Floriano, 2006, Journal of Biological Chemistry.

Dielectric Constant and Density of Water as a Function of Pressure at Constant Temperature

Wely B. Floriano, M. Nascimento, W. Floriano, 2004 .

Erratum to: Functional variants of human papillomavirus type 16 demonstrate host genome integration and transcriptional alterations corresponding to their unique cancer epidemiology

Wely B. Floriano, A. Nicolas, P. Lambert, 2016, BMC Genomics.

Interaction of e. coli outer‐membrane protein A with sugars on the receptors of the brain microvascular endothelial cells

Wely B. Floriano, W. Goddard, N. Vaidehi, 2002, Proteins.

Exposure to Long Magnetic Resonance Imaging Thermometry Does Not Cause Significant DNA Double-Strand Breaks on CF-1 Mice

Wely B. Floriano, L. Curiel, W. Floriano, 2022, Journal of Modern Physics.

Theoretical study of arginine-carboxylate interactions

Wely B. Floriano, N. Reuter, B. Maigret, 1999 .

Paclitaxel is an inhibitor and its boron dipyrromethene derivative is a fluorescent recognition agent for botulinum neurotoxin subtype A.

Wely B. Floriano, Z. Ramjan, W. Floriano, 2013, Journal of medicinal chemistry.

Effects of pressure on the structure of metmyoglobin: Molecular dynamics predictions for pressure unfolding through a molten globule intermediate

Wely B. Floriano, W. Goddard, G. Domont, 1998, Protein science : a publication of the Protein Society.

A generalized multistructural description of the ground state of ozone and water molecules

Wely B. Floriano, M. Nascimento, W. Floriano, 1995 .

Favorable adsorption of capped amino acids on graphene substrate driven by desolvation effect.

Wely B. Floriano, O. Rubel, G. Fanchini, 2013, The Journal of chemical physics.

Binding of solvated peptide (EPLQLKM) with a graphene sheet via simulated coarse-grained approach.

Wely B. Floriano, R. Naik, R. Pandey, 2014, Journal of Chemical Physics.

Identifying potential selective fluorescent probes for cancer-associated protein carbonic anhydrase IX using a computational approach.

Wely B. Floriano, W. Floriano, Rhiannon L. Kamstra, 2014, Journal of molecular graphics & modelling.

Functional variants of human papillomavirus type 16 demonstrate host genome integration and transcriptional alterations corresponding to their unique cancer epidemiology

Wely B. Floriano, A. Nicolas, P. Lambert, 2016, BMC Genomics.

Modeling enzyme–inhibitor interactions in serine proteases

Maria J. Ramos, Nathalie Reuter, Bernard Maigret, 1999 .

An atomic charge model for graphene oxide for exploring its bioadhesive properties in explicit water.

Wely B. Floriano, S. French, O. Rubel, 2014, The Journal of chemical physics.