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Sandeep Pal

Design and Application of a DNA-Encoded Macrocyclic Peptide Library
2017 · Zhengrong Zhu, Alex Shaginian, et al. · ACS Chemical Biology · 103
Improving the passive permeability of macrocyclic peptides: Balancing permeability with other physicochemical properties
2014 · Praew Thansandote, Robert M. Harris, et al. · Bioorganic & Medicinal Chemistry · 64
Effect of Nanostructure on the Properties of Water at the Water−Hydrophobic Interface: A Molecular Dynamics Simulation
2005 · Sandeep Pal, Horst Weiss, et al. · Langmuir · 43
Study of Human Orexin-1 and -2 G-Protein-Coupled Receptors with Novel and Published Antagonists by Modeling, Molecular Dynamics Simulations, and Site-Directed Mutagenesis
2012 · Alexander Heifetz, G. Benjamin Morris, et al. · Biochemistry · 42
Dissipative Particle Dynamics Simulations of Polymer Brushes: Comparison with Molecular Dynamics Simulations
2006 · Sandeep Pal, Christian Seidel · Macromolecular Theory and Simulations · 39
Ion Exchange in Reverse Micelles
2004 · Sandeep Pal, G. Vishal, et al. · Langmuir · 34
Synthetic Polymers and Biomembranes. How Do They Interact?: Atomistic Molecular Dynamics Simulation Study of PEO in Contact with a DMPC Lipid Bilayer
2006 · Sandeep Pal, Giuseppe Milano, et al. · The Journal of Physical Chemistry B · 28
Molecular Dynamics Simulation of Aqueous NaF and NaI Solutions near a Hydrophobic Surface
2005 · Sandeep Pal, Florian Müller-Plathe · The Journal of Physical Chemistry B · 28
Discovery of 3-Oxabicyclo[4.1.0]heptane, a Non-nitrogen Containing Morpholine Isostere, and Its Application in Novel Inhibitors of the PI3K-AKT-mTOR Pathway
2019 · Heather Hobbs, Gianpaolo Bravi, et al. · Journal of Medicinal Chemistry · 26
Fighting Obesity with a Sugar-Based Library: Discovery of Novel MCH-1R Antagonists by a New Computational–VAST Approach for Exploration of GPCR Binding Sites
2013 · Alexander Heifetz, Oliver Barker, et al. · Journal of Chemical Information and Modeling · 25
Molecular Dynamics Simulation of Water Near Nanostructured Hydrophobic Surfaces: Interfacial Energies
2005 · Sandeep Pal, Danilo Roccatano, et al. · ChemPhysChem · 22
The discovery of potent and selective kynurenine 3-monooxygenase inhibitors for the treatment of acute pancreatitis
2017 · John Liddle, Benjamin Beaufils, et al. · Bioorganic & Medicinal Chemistry Letters · 21
The hydrophobicity of nanostructured alkane and perfluoro alkane surfaces: A comparison by molecular dynamics simulation
2005 · Sandeep Pal, Horst Weiss, et al. · Physical Chemistry Chemical Physics · 15
Tutorial: Can Nanostructuring Improve the Properties of Hydrophobic Surfaces?
2005 · Florian Müller‐Plathe, Sandeep Pal, et al. · Soft Materials · 12
Discovery of the first potent and selective αvβ5 integrin inhibitor based on an amide-containing core
2020 · Rhys A. Lippa, John Barrett, et al. · European Journal of Medicinal Chemistry · 11
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In Vivo Half-Life Extension of BMP1/TLL Metalloproteinase Inhibitors Using Small-Molecule Human Serum Albumin Binders
2021 · Julien C. Vantourout, Andrew M. Mason, et al. · Bioconjugate Chemistry · 10
Protein–protein docking: Progress in CAPRI rounds 6–12 using a combination of methods: The introduction of steered solvated molecular dynamics
2007 · Alexander Heifetz, Sandeep Pal, et al. · Proteins Structure Function and Bioinformatics · 9
The Design of Potent, Selective and Drug‐Like RGD αvβ1 Small‐Molecule Inhibitors Derived from non‐RGD α4β1 Antagonists
2019 · Richard J. D. Hatley, Tim N. Barrett, et al. · ChemMedChem · 8
Molecule Ideation Using Matched Molecular Pairs
2021 · Sandeep Pal, Peter Pogány, et al. · Methods in molecular biology · 7
DNA-Encoded Macrocyclic Peptide Library
2019 · Zhengrong Zhu, Alex Shaginian, et al. · Methods in molecular biology · 5
Discovery of novel amino-pyrimidine inhibitors of the insulin-like growth factor 1 (IGF1R) and insulin receptor (INSR) kinases; parallel optimization of cell potency and hERG inhibition
2015 · Heather Tye, Ulrich Guertler, et al. · MedChemComm · 3
2-Hydroxypropyl-β-cyclodextrin, solubiliser in a novel dantrolene formulation: Its binding affinities to clinical compounds that may be used during anaesthesia or management of malignant hyperthermia
2025 · Richard H. Ng Kwet Shing, David J. Wright, et al. · European Journal of Pharmaceutics and Biopharmaceutics · 1
Molecular dynamics simulation of water near structured hydrophobic surfaces
2005 · Sandeep Pal · 1
Accelerating BRPF1b hit identification with BioPhysical and Active Learning Screening (BioPALS)
2024 · Sandeep Pal, Zandile Nare, et al. · ChemMedChem
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Correction to Discovery of 3-Oxabicyclo[4.1.0]heptane, a Non-nitrogen Containing Morpholine Isostere, and Its Application in Novel Inhibitors of the PI3K-AKT-mTOR Pathway
2019 · Heather Hobbs, Gianpaolo Bravi, et al. · Journal of Medicinal Chemistry
Works count: 27
Citation count: 557
H-index: 13
I10-index: 16
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