(Q48282864)

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:29315651%20AND%20SRC:MED&resulttype=core&format=json

8 April 2020

title

Yoink: An interaction-based partitioning API (English)

1 reference

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8 April 2020

2

1 reference

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:29315651%20AND%20SRC:MED&resulttype=core&format=json

8 April 2020

author name string

Min Zheng

series ordinal

1

1 reference

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:29315651%20AND%20SRC:MED&resulttype=core&format=json

8 April 2020

publication date

5 January 2018

1 reference

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:29315651%20AND%20SRC:MED&resulttype=core&format=json

Journal of Computational Chemistry

8 April 2020

published in

1 reference

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:29315651%20AND%20SRC:MED&resulttype=core&format=json

8 April 2020

volume

39

1 reference

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:29315651%20AND%20SRC:MED&resulttype=core&format=json

8 April 2020

issue

13

1 reference

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:29315651%20AND%20SRC:MED&resulttype=core&format=json

8 April 2020

page(s)

799-806

1 reference

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:29315651%20AND%20SRC:MED&resulttype=core&format=json

Effect of the damping function in dispersion corrected density functional theory.

8 April 2020

cites work

1 reference

Revealing noncovalent interactions

21 January 2018

1 reference

Simultaneous Visualization of Covalent and Noncovalent Interactions Using Regions of Density Overlap.

21 January 2018

1 reference

NCIPLOT: a program for plotting non-covalent interaction regions

21 January 2018

1 reference

Atomic shell structure from the Single-Exponential Decay Detector.

21 January 2018

1 reference

Role of Dispersion in Metallophilic Hg···M Interactions (M = Cu, Ag, Au) within Coinage Metal Complexes of Bis(6-diphenylphosphinoacenaphth-5-yl)mercury.

21 January 2018

1 reference

A density-based adaptive quantum mechanical/molecular mechanical method.

21 January 2018

1 reference

Solving the scalability issue in quantum-based refinement: Q|R#1.

21 January 2018

1 reference

Multiwfn: a multifunctional wavefunction analyzer

21 January 2018

1 reference

Multiscale Modeling of Chemistry in Water: Are We There Yet?

21 January 2018

1 reference

Application of Adaptive QM/MM Methods to Molecular Dynamics Simulations of Aqueous Systems

21 January 2018

1 reference

Cation solvation with quantum chemical effects modeled by a size-consistent multi-partitioning quantum mechanics/molecular mechanics method.

21 January 2018

1 reference

Adaptive-partitioning QM/MM for molecular dynamics simulations: 4. Proton hopping in bulk water.

21 January 2018

1 reference

Developing adaptive QM/MM computer simulations for electrochemistry.

21 January 2018

1 reference

Adaptive partitioning in combined quantum mechanical and molecular mechanical calculations of potential energy functions for multiscale simulations.

21 January 2018

1 reference

An Algorithm for Adaptive QC/MM Simulations.

21 January 2018

1 reference

Toward Hamiltonian Adaptive QM/MM: Accurate Solvent Structures Using Many-Body Potentials

21 January 2018

1 reference

Fragment quantum mechanical calculation of proteins and its applications

21 January 2018

1 reference

Extending the power of quantum chemistry to large systems with the fragment molecular orbital method

21 January 2018

1 reference

Modelling Chemical Reasoning to Predict and Invent Reactions

21 January 2018

1 reference

Open source clustering software

21 January 2018

1 reference

Cytoscape: a software environment for integrated models of biomolecular interaction networks

21 January 2018

1 reference

Network visualization and analysis of gene expression data using BioLayout Express(3D).

21 January 2018

1 reference

OpenMM 4: A Reusable, Extensible, Hardware Independent Library for High Performance Molecular Simulation

21 January 2018

1 reference

PHENIX: a comprehensive Python-based system for macromolecular structure solution

21 January 2018

1 reference

PyADF--a scripting framework for multiscale quantum chemistry

21 January 2018

1 reference

PyRosetta: a script-based interface for implementing molecular modeling algorithms using Rosetta

21 January 2018

1 reference

Fast unfolding of communities in large networks

21 January 2018

1 reference

NMR structure note: solution structure of human Miz-1 zinc fingers 8 to 10

21 January 2018

1 reference

Global Optimization by Basin-Hopping and the Lowest Energy Structures of Lennard-Jones Clusters Containing up to 110 Atoms

21 January 2018

1 reference

Structural relaxation made simple.

21 January 2018

1 reference

On the limited memory BFGS method for large scale optimization

21 January 2018

1 reference

GROMACS 4.5: a high-throughput and highly parallel open source molecular simulation toolkit

21 January 2018

1 reference

Comparison of multiple Amber force fields and development of improved protein backbone parameters

21 January 2018

1 reference

Network Analysis of Protein Structures Identifies Functional Residues

21 January 2018

1 reference

Noncovalent Interactions: A Challenge for Experiment and Theory

21 January 2018

1 reference

Toward a Practical Method for Adaptive QM/MM Simulations

21 January 2018

1 reference

Mixing local and global information for community detection in large networks

21 January 2018

1 reference

Extracting information about chemical bonding from molecular electron densities via single exponential decay detector (SEDD)

21 January 2018

1 reference

COCI

https://opencitations.net/index/coci/api/v1/citations/10.2533/CHIMIA.2013.253

8 July 2023

Identifiers

DOI

10.1002/JCC.25146

1 reference

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:29315651%20AND%20SRC:MED&resulttype=core&format=json

8 April 2020

DBLP publication ID

journals/jcc/ZhengW18

1 reference

DBLP Dataset 2021-01-02

28 January 2021

1 reference