Related references
Note: Only part of the references are listed.Hierarchically Structured Porous Piezoelectric Polymer Nanofibers for Energy Harvesting
Mohammad Mahdi Abolhasani et al.
ADVANCED SCIENCE (2020)
Modeling and Simulations of Polymers: A Roadmap
Thomas E. Gartner et al.
MACROMOLECULES (2019)
Role of Solvation on Diffusion of Ions in Diblock Copolymers: Understanding the Molecular Weight Effect through Modeling
Youngmi Seo et al.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2019)
CHARMM-GUI Membrane Builder for Complex Biological Membrane Simulations with Glycolipids and Lipoglycans
Jumin Lee et al.
JOURNAL OF CHEMICAL THEORY AND COMPUTATION (2019)
Systematic Study of Thermal and (Bio)Degradable Properties of Semiaromatic Copolyesters Based on Naturally Occurring Isosorbide
Jingying Chen et al.
ACS SUSTAINABLE CHEMISTRY & ENGINEERING (2019)
Conjugated Polymer Actuators and Devices: Progress and Opportunities
Daniel Melling et al.
ADVANCED MATERIALS (2019)
Hyperconjugation-induced chromism in linear responsive polymers
Yeol Kyo Choi et al.
JOURNAL OF MATERIALS CHEMISTRY C (2019)
Stimuli-responsive bio-based polymeric systems and their applications
Shuting Gao et al.
JOURNAL OF MATERIALS CHEMISTRY B (2019)
Single-Junction Organic Solar Cell with over 15% Efficiency Using Fused-Ring Acceptor with Electron-Deficient Core
Jun Yuan et al.
JOULE (2019)
CHARMM-GUI Glycan Modeler for modeling and simulation of carbohydrates and glycoconjugates
Sang-Jun Park et al.
GLYCOBIOLOGY (2019)
Transferable MARTINI Model of Poly(ethylene Oxide)
Fabian Grunewald et al.
JOURNAL OF PHYSICAL CHEMISTRY B (2018)
Hydroxide ions transportation in polynorbornene anion exchange membrane
Chao Wang et al.
POLYMER (2018)
Formation of nanopores in DiynePC-DPPC complex lipid bilayers triggered by on-demand photo-polymerization
Min Jung Chun et al.
RSC ADVANCES (2018)
Modeling Polymer Glass Transition Properties from Empirical Monomer Data with the SAFT-γ Mie Force Field
Amulya K. Pervaje et al.
MACROMOLECULES (2018)
Nanopatterning via Solvent Vapor Annealing of Block Copolymer Thin Films
Cong Jin et al.
CHEMISTRY OF MATERIALS (2017)
Machine Learning Force Fields: Construction, Validation, and Outlook
V. Botu et al.
JOURNAL OF PHYSICAL CHEMISTRY C (2017)
Transferable coarse-grained model for perfluorosulfonic acid polymer membranes
An-Tsung Kuo et al.
JOURNAL OF CHEMICAL PHYSICS (2017)
CHARMM-GUI ligand reader and modeler for CHARMM force field generation of small molecules
Seonghoon Kim et al.
JOURNAL OF COMPUTATIONAL CHEMISTRY (2017)
Bulk Heterojunction Morphologies with Atomistic Resolution from Coarse-Grain Solvent Evaporation Simulations
Riccardo Alessandri et al.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2017)
Conjugated Polymer Nanoparticles in Aqueous Media by Assembly with Phospholipids via Dense Alkyl Chain Packing
Yeol Kyo Choi et al.
MACROMOLECULES (2017)
Enhanced Thermal Stability of Polyaniline with Polymerizable Dopants
Yeol Kyo Choi et al.
MACROMOLECULES (2017)
OpenMM 7: Rapid development of high performance algorithms for molecular dynamics
Peter Eastman et al.
PLOS COMPUTATIONAL BIOLOGY (2017)
Glycan Reader is improved to recognize most sugar types and chemical modifications in the Protein Data Bank
Sang-Jun Park et al.
BIOINFORMATICS (2017)
Engineering the Surface of Smart Nanocarriers Using a pH-/Thermal-/GSH-Responsive Polymer Zipper for Precise Tumor Targeting Therapy In Vivo
Penghui Zhang et al.
ADVANCED MATERIALS (2017)
pysimm: A python package for simulation of molecular systems
Michael E. Fortunato et al.
SOFTWAREX (2017)
Directed Assembly of Soft Colloids through Rapid Solvent Exchange
Arash Nikoubashman et al.
ACS NANO (2016)
CHARMM-GUI Input Generator for NAMD, GROMACS, AMBER, OpenMM, and CHARMM/OpenMM Simulations Using the CHARMM36 Additive Force Field
Jumin Lee et al.
JOURNAL OF CHEMICAL THEORY AND COMPUTATION (2016)
MARTINI Coarse-Grained Models of Polyethylene and Polypropylene
Emanuele Panizon et al.
JOURNAL OF PHYSICAL CHEMISTRY B (2015)
Wetting-Dewetting and Dispersion Aggregation Transitions Are Distinct for Polymer Grafted Nanoparticles in Chemically Dissimilar Polymer Matrix
Tyler B. Martin et al.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2015)
Learning scheme to predict atomic forces and accelerate materials simulations
V. Botu et al.
PHYSICAL REVIEW B (2015)
Flory-Huggins parameter χ, from binary mixtures of Lennard-Jones particles to block copolymer melts
Alexandros Chremos et al.
JOURNAL OF CHEMICAL PHYSICS (2014)
CHARMM-GUI Membrane Builder Toward Realistic Biological Membrane Simulations
Emilia L. Wu et al.
JOURNAL OF COMPUTATIONAL CHEMISTRY (2014)
Polystyrene Nanoparticles Perturb Lipid Membranes
Giulia Rossi et al.
JOURNAL OF PHYSICAL CHEMISTRY LETTERS (2014)
CHARMM-GUI Micelle Builder for Pure/Mixed Micelle and Protein/Micelle Complex Systems
Xi Cheng et al.
JOURNAL OF CHEMICAL INFORMATION AND MODELING (2013)
Computational modeling of structure and OH-anion diffusion in quaternary ammonium polysulfone hydroxide - Polymer electrolyte for application in electrochemical devices
Boris V. Merinov et al.
JOURNAL OF MEMBRANE SCIENCE (2013)
Prediction of drug-polymer miscibility through the use of solubility parameter based flory-huggins interaction parameter and the experimental validation: PEG as model polymer
Seema Thakral et al.
JOURNAL OF PHARMACEUTICAL SCIENCES (2013)
Polymatic: a generalized simulated polymerization algorithm for amorphous polymers
Lauren J. Abbott et al.
THEORETICAL CHEMISTRY ACCOUNTS (2013)
A Coarse-Grained MARTINI Model of Polyethylene Glycol and of Polyoxyethylene Alkyl Ether Surfactants
G. Rossi et al.
JOURNAL OF PHYSICAL CHEMISTRY B (2012)
Emerging applications of stimuli-responsive polymer materials
Martien A. Cohen Stuart et al.
NATURE MATERIALS (2010)
Block Copolymer Nanolithography: Translation of Molecular Level Control to Nanoscale Patterns
Joona Bang et al.
ADVANCED MATERIALS (2009)
PACKMOL: A Package for Building Initial Configurations for Molecular Dynamics Simulations
L. Martinez et al.
JOURNAL OF COMPUTATIONAL CHEMISTRY (2009)
CHARMM: The Biomolecular Simulation Program
B. R. Brooks et al.
JOURNAL OF COMPUTATIONAL CHEMISTRY (2009)
Prediction of Hansen solubility parameters with a new group-contribution method
Emmanuel Stefanis et al.
INTERNATIONAL JOURNAL OF THERMOPHYSICS (2008)
The multiscale coarse-graining method. I. A rigorous bridge between atomistic and coarse-grained models
W. G. Noid et al.
JOURNAL OF CHEMICAL PHYSICS (2008)
Software news and updates - CHARNIM-GUI: A web-based grraphical user interface for CHARMM
Sunhwan Jo et al.
JOURNAL OF COMPUTATIONAL CHEMISTRY (2008)
Monte Carlo simulation of short chain branched polyolefins in the molten state
Javier Ramos et al.
MACROMOLECULES (2007)
Automated Builder and Database of Protein/Membrane Complexes for Molecular Dynamics Simulations
Sunhwan Jo et al.
PLOS ONE (2007)
Molecular dynamics simulations of comb-branched poly(epoxide ether)-based polymer electrolytes
Oleg Borodin et al.
MACROMOLECULES (2007)
Scalable molecular dynamics with NAMD
JC Phillips et al.
JOURNAL OF COMPUTATIONAL CHEMISTRY (2005)
The Amber biomolecular simulation programs
DA Case et al.
JOURNAL OF COMPUTATIONAL CHEMISTRY (2005)
Self-assembly and properties of diblock copolymers by coarse-grain molecular dynamics
G Srinivas et al.
NATURE MATERIALS (2004)
A Flory-Huggins model based on the Hansen solubility parameters
T Lindvig et al.
FLUID PHASE EQUILIBRIA (2002)
Microfabricating conjugated polymer actuators
EWH Jager et al.
SCIENCE (2000)
Share Paper
