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Introduction to automata theory, languages and computation

Effect of the damping function in dispersion corrected density functional theory

STRING v10: protein–protein interaction networks, integrated over the tree of life

A consistent and accurate<i>ab initio</i>parametrization of density functional dispersion correction (DFT-D) for the 94 elements H-Pu

Application of Phylogenetic Networks in Evolutionary Studies

Interactive Tree Of Life (iTOL) v5: an online tool for phylogenetic tree display and annotation

A new mixing of Hartree–Fock and local density-functional theories

Information Theory and Statistical Mechanics

Balanced basis sets of split valence, triple zeta valence and quadruple zeta valence quality for H to Rn: Design and assessment of accuracy

The M06 suite of density functionals for main group thermochemistry, thermochemical kinetics, noncovalent interactions, excited states, and transition elements: two new functionals and systematic testing of four M06-class functionals and 12 other functionals

Density-functional thermochemistry. III. The role of exact exchange

Efficiency of ab-initio total energy calculations for metals and semiconductors using a plane-wave basis set

A new optimizer using particle swarm theory

Fast unfolding of communities in large networks

ff14SB: Improving the Accuracy of Protein Side Chain and Backbone Parameters from ff99SB

Rethinking the Inception Architecture for Computer Vision

IQ-TREE 2: New Models and Efficient Methods for Phylogenetic Inference in the Genomic Era

MEGA5: Molecular Evolutionary Genetics Analysis Using Maximum Likelihood, Evolutionary Distance, and Maximum Parsimony Methods

The ORCA program system

Scalable molecular dynamics with NAMD

Chemistry with ADF

First-principles simulation: ideas, illustrations and the CASTEP code

First principles methods using CASTEP

An all-electron numerical method for solving the local density functional for polyatomic molecules