Design of Metal-Organic Framework Templated Materials Using High-Throughput Computational Screening

Advances in Conjugated Microporous Polymers

(2020) Jet-Sing M. Lee et al.   CHEMICAL REVIEWS

MOF-Polymer Hybrid Materials: From Simple Composites to Tailored Architectures

(2020) Mark Kalaj et al.   CHEMICAL REVIEWS

Functional π-Conjugated Two-Dimensional Covalent Organic Frameworks

(2019) H. Vignesh Babu et al.   ACS Applied Materials & Interfaces

Metal–Organic Framework-Templated Biomaterials: Recent Progress in Synthesis, Functionalization, and Applications

(2019) Salma Begum et al.   ACCOUNTS OF CHEMICAL RESEARCH

Rising Up: Hierarchical Metal-Organic Frameworks in Experiments and Simulations

(2019) Yi Luo et al.   ADVANCED MATERIALS

A unifying review of polymer networks: from rubbers and gels to porous frameworks

(2019) Yuwei Gu et al.   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

Tuning the Negative Thermal Expansion Behavior of the Metal–Organic Framework Cu3BTC2 by Retrofitting

(2019) Christian Schneider et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Identification of evolutionary and kinetic drivers of NAD-dependent signaling

(2019) Mathias Bockwoldt et al.   PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA

Advances, Updates, and Analytics for the Computation-Ready, Experimental Metal–Organic Framework Database: CoRE MOF 2019

(2019) Yongchul G. Chung et al.   JOURNAL OF CHEMICAL AND ENGINEERING DATA

Retrofitting metal-organic frameworks

(2019) Christian Schneider et al.   Nature Communications

Improving the Mechanical Stability of Metal–Organic Frameworks Using Chemical Caryatids

(2018) Seyed Mohamad Moosavi et al.   ACS Central Science

High-Throughput Screening of Metal–Organic Frameworks for Macroscale Heteroepitaxial Alignment

(2018) Andrew Tarzia et al.   ACS Applied Materials & Interfaces

Secondary building units as the turning point in the development of the reticular chemistry of MOFs

(2018) Markus J. Kalmutzki et al.   Science Advances

Interconversion between Free Charges and Bound Excitons in 2D Hybrid Lead Halide Perovskites

(2017) María C. Gélvez-Rueda et al.   Journal of Physical Chemistry C

Porous Metal–Organic Polyhedral Frameworks with Optimal Molecular Dynamics and Pore Geometry for Methane Storage

(2017) Yong Yan et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Ultrafast rotation in an amphidynamic crystalline metal organic framework

(2017) Cortnie S. Vogelsberg et al.   PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA

Tailoring porosity and rotational dynamics in a series of octacarboxylate metal-organic frameworks

(2017) Florian Moreau et al.   PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA

Defibrillation of soft porous metal-organic frameworks with electric fields

(2017) A. Knebel et al.   SCIENCE

The atom, the molecule, and the covalent organic framework

(2017) Christian S. Diercks et al.   SCIENCE

Molecular weaving via surface-templated epitaxy of crystalline coordination networks.

(2017) Zhengbang Wang et al.   Nature Communications

Emerging Applications of Metal–Organic Frameworks and Covalent Organic Frameworks

(2016) Yanli Zhao   CHEMISTRY OF MATERIALS

High-Throughput Screening of Metal–Organic Frameworks for Hydrogen Storage at Cryogenic Temperature

(2016) N. Scott Bobbitt et al.   Journal of Physical Chemistry C

High-throughput computational screening of metal–organic frameworks

(2014) Yamil J. Colón et al.   CHEMICAL SOCIETY REVIEWS

Extension of the Universal Force Field to Metal–Organic Frameworks

(2014) Matthew A. Addicoat et al.   Journal of Chemical Theory and Computation

AuToGraFS: Automatic Topological Generator for Framework Structures

(2014) Matthew A. Addicoat et al.   JOURNAL OF PHYSICAL CHEMISTRY A

High-Throughput Screening of Porous Crystalline Materials for Hydrogen Storage Capacity near Room Temperature

(2014) Yamil J. Colón et al.   Journal of Physical Chemistry C

In silico Design of Porous Polymer Networks: High-Throughput Screening for Methane Storage Materials

(2014) Richard L. Martin et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

eSBMTools 1.0: enhanced native structure-based modeling tools

(2013) Benjamin Lutz et al.   BIOINFORMATICS

Python Materials Genomics (pymatgen): A robust, open-source python library for materials analysis

(2012) Shyue Ping Ong et al.   COMPUTATIONAL MATERIALS SCIENCE

Avogadro: an advanced semantic chemical editor, visualization, and analysis platform

(2012) Marcus D Hanwell et al.   Journal of Cheminformatics

Algorithms and tools for high-throughput geometry-based analysis of crystalline porous materials

(2011) Thomas F. Willems et al.   MICROPOROUS AND MESOPOROUS MATERIALS