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LIPID11: A Modular Framework for Lipid Simulations Using Amber

The journal of physical chemistry. B, 2012-09, Vol.116 (36), p.11124-11136

2012

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Crystal structure and ab initio calculations of CaZrO3

Journal of the European Ceramic Society, 2012-03, Vol.32 (3), p.665-670

2012

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Lipid14: The Amber Lipid Force Field

Journal of chemical theory and computation, 2014-02, Vol.10 (2), p.865-879

2014

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AMPL: A Data-Driven Modeling Pipeline for Drug Discovery

Journal of chemical information and modeling, 2020-04, Vol.60 (4), p.1955-1968

2020

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Vibrational spectra of a baghdadite synthetic analogue

Vibrational spectroscopy, 2015-01, Vol.76, p.1-5

2015

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Polymorphism, structure and dynamics investigations of 4-cyano-3-fluorophenyl 4′-n-octylbenzoate (8CFPB) liquid crystal

Vibrational spectroscopy, 2017-09, Vol.92, p.119-126

2017

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A Parameterization of Cholesterol for Mixed Lipid Bilayer Simulation within the Amber Lipid14 Force Field

The journal of physical chemistry. B, 2015-09, Vol.119 (38), p.12424-12435

2015

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Predicting Volume of Distribution in Humans: Performance of In Silico Methods for a Large Set of Structurally Diverse Clinical Compounds

Drug metabolism and disposition, 2021-02, Vol.49 (2), p.169-178

2021

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All-atom lipid bilayer self-assembly with the AMBER and CHARMM lipid force fields

Chemical communications (Cambridge, England), 2015-03, Vol.51 (21), p.4402-4405

2015

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Simulation of lipid bilayer self-assembly using all-atom lipid force fields

Physical chemistry chemical physics : PCCP, 2016-04, Vol.18 (15), p.10573-10584

2016

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The impact of work environment on chemical and phase composition changes of magnesia-spinel refractories used as refractory lining in secondary metallurgy device

IOP conference series. Materials Science and Engineering, 2013-01, Vol.47 (1), p.12020-6

2013

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Products of hydratation in fine grained mixtures MgO – SiO2

IOP conference series. Materials Science and Engineering, 2013, Vol.47 (1)

2013

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One-year Mediterranean diet promotes epigenetic rejuvenation with country- and sex-specific effects: a pilot study from the NU-AGE project

GeroScience, 2020-04, Vol.42 (2), p.687-701

2020

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The Role of Self-Esteem in the Relationship Between Loneliness and Life Satisfaction in Late Adulthood: Evidence from Poland

Psychology research and behavior management, 2020-01, Vol.13, p.1201-1212

2020

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Non-asymptotic approach to ultrasonic attenuation in nitroethane–isooctane critical mixture

Journal of physics. Condensed matter, 2002-12, Vol.14 (49), p.13429-13439

2002

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Ca7ZrAl6O18 acting as a hydraulic and ceramic bonding in the MgO–CaZrO3 dense refractory composite

Ceramics international, 2014-06, Vol.40 (5), p.7315-7320

2014

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Structural properties of 0.8CaZrO3–0.2CaFe2O4 composite

Ceramics international, 2015-08, Vol.41 (7), p.8688-8695

2015

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Predicting Volume of Distribution in Humans: Performance of In Silico Methods for a Large Set of Structurally Diverse Clinical Compounds

Drug metabolism and disposition, 2020-11, Vol.49 (2)

2020

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Applications of hidden Markov models in bar code decoding

Pattern recognition letters, 2006-10, Vol.27 (14), p.1665-1672

2006

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Half-Life of the Duck Hepatitis B Virus Covalently Closed Circular DNA Pool In Vivo following Inhibition of Viral Replication

Journal of Virology, 2002-06, Vol.76 (12), p.6356-6363

2002

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Products of hydratation in fine grained mixtures MgO – SiO 2

IOP conference series. Materials Science and Engineering, 2013-12, Vol.47, p.12046

2013

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Products of hydratation in fine grained mixtures MgO - SiO sub(2)

IOP conference series. Materials Science and Engineering, 2013-01, Vol.47, p.1-4

2013

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Simulation of lipid bilayer self-assembly using all-atom lipid force fieldsElectronic supplementary information (ESI) available. See DOI: 10.1039/c5cp07379k

2016-04

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All-atom lipid bilayer self-assembly with the AMBER and CHARMM lipid force fieldsElectronic supplementary information (ESI) available: Videos from self-assembly simulations (accompanying captions provided in the PDF file), a detailed methods section, simulation system details, additional properties calculated for the self-assembled bilayers, figures showing the PC and PE head group charges in Lipid14 and C36 as well as snapshots from C36 DPPC self-assembly are included. See DOI: 10.1039/c4cc0958

2015-02

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Influence of Microsilica on Mechanical Properties of basic Castables

Proceedings of the Unified International Technical Conference on Refractories (UNITECR 2013), 2014, p.1013-1018

2014

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LIPID11: A Modular Framework for Lipid Simulations Using Amber

Crystal structure and ab initio calculations of CaZrO3

Lipid14: The Amber Lipid Force Field

AMPL: A Data-Driven Modeling Pipeline for Drug Discovery

Vibrational spectra of a baghdadite synthetic analogue

Polymorphism, structure and dynamics investigations of 4-cyano-3-fluorophenyl 4′-n-octylbenzoate (8CFPB) liquid crystal

A Parameterization of Cholesterol for Mixed Lipid Bilayer Simulation within the Amber Lipid14 Force Field

Predicting Volume of Distribution in Humans: Performance of In Silico Methods for a Large Set of Structurally Diverse Clinical Compounds

All-atom lipid bilayer self-assembly with the AMBER and CHARMM lipid force fields

Simulation of lipid bilayer self-assembly using all-atom lipid force fields

The impact of work environment on chemical and phase composition changes of magnesia-spinel refractories used as refractory lining in secondary metallurgy device

Products of hydratation in fine grained mixtures MgO – SiO2

One-year Mediterranean diet promotes epigenetic rejuvenation with country- and sex-specific effects: a pilot study from the NU-AGE project

The Role of Self-Esteem in the Relationship Between Loneliness and Life Satisfaction in Late Adulthood: Evidence from Poland

Non-asymptotic approach to ultrasonic attenuation in nitroethane–isooctane critical mixture

Ca7ZrAl6O18 acting as a hydraulic and ceramic bonding in the MgO–CaZrO3 dense refractory composite

Structural properties of 0.8CaZrO3–0.2CaFe2O4 composite

Predicting Volume of Distribution in Humans: Performance of In Silico Methods for a Large Set of Structurally Diverse Clinical Compounds

Applications of hidden Markov models in bar code decoding

Half-Life of the Duck Hepatitis B Virus Covalently Closed Circular DNA Pool In Vivo following Inhibition of Viral Replication

Products of hydratation in fine grained mixtures MgO – SiO 2

Products of hydratation in fine grained mixtures MgO - SiO sub(2)

Simulation of lipid bilayer self-assembly using all-atom lipid force fieldsElectronic supplementary information (ESI) available. See DOI: 10.1039/c5cp07379k

Influence of Microsilica on Mechanical Properties of basic Castables

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