Year of publication
Subject
Type of material
Licence
TIB reading rooms collection
1–20 of 33,050 hits
Sort by:
Sort by:
-
Molecular modeling in the age of clinical genomics, the enterprise of the next generation
Online Contents | 2017|Keywords: Molecular dynamics -
Reaction pathway of oxygen evolution on Pt(1 1 1) revealed through constant Fermi level molecular dynamics
Elsevier | 2019|Keywords: Molecular dynamics, Constant Fermi level molecular dynamics -
Metadynamics combined with auxiliary density functional and density functional tight-binding methods: alanine dipeptide as a case study
Online Contents | 2017|Keywords: Molecular dynamics -
Investigating the glass transition temperature at the atom-level in select model polyamides: A molecular dynamics study
Elsevier | 2015|Keywords: Molecular dynamics -
Constructing high‐dimensional neural network potentials: A tutorial review
Wiley | 2015|Keywords: molecular dynamics -
Enhanced sampling techniques in molecular dynamics simulations of biological systems
Elsevier | 2014|Keywords: Molecular dynamics, Replica-exchange molecular dynamics -
Combination of anti-hypertensive drugs: a molecular dynamics simulation study
Online Contents | 2017|Keywords: Molecular dynamics -
Integral equations theory for two-dimensional systems involving nanoparticles
Online Contents | 2017|Keywords: molecular dynamics, Molecular dynamics -
pH‐dependent conformational dynamics of beta‐secretase 1: A molecular dynamics study
Wiley | 2019|Keywords: molecular dynamics, constant pH molecular dynamics -
Elucidating NH2-I3V3A3G3K3-COOH and NH2-K3G3A3V3I3-COOH polypeptide membranes: A classical molecular dynamics study
Elsevier | 2019|Keywords: Molecular dynamics -
An assessment of optimal time scale of conformational resampling for parallel cascade selection molecular dynamics
Taylor & Francis Verlag | 2018|Keywords: molecular dynamics simulation, selection molecular dynamics -
Recent advances in maximum entropy biasing techniques for molecular dynamics
Free accessTaylor & Francis Verlag | 2019|Keywords: Molecular dynamics -
The dependence on ammonia pretreatment of N−O activation by Co(II) sites in zeolites: a DFT and ab initio molecular dynamics study
Online Contents | 2017|Keywords: Molecular dynamics -
Molecular dynamics simulations on adhesion energy of PDMS-silica interface caused by molecular structures and temperature
Elsevier | 2021|Keywords: Molecular dynamics simulation -
A theoretical study on Zn binding loop mutants instigating destabilization and metal binding loss in human SOD1 protein
Online Contents | 2017|Keywords: Molecular dynamics -
Design and analysis of polypeptide nanofiber using full atomistic Molecular Dynamic
Elsevier | 2020|Keywords: Molecular Dynamics -
Development of physics based analytical interatomic potential for palladium-hydride
Online Contents | 2017|Keywords: Molecular dynamics -
Molecular Dynamics Simulation of Ethylene/Hexene Copolymer Adsorption onto Graphene: New Insight into Thermal Gradient Interaction Chromatography
Wiley | 2019|Keywords: molecular dynamics -
Accurate analytic intermolecular potential for the simulation of Na+ and K+ ion hydration in liquid water
Elsevier | 2015|Keywords: Molecular dynamics
Send my search to (beta)
Send your search query (search terms without filters) to other databases, portals and catalogues to find more interesting hits.
Dimensions:
full data search
or
title and abstract search
Dimensions is a database for abstracts and citations that links information on research funding with the resulting publications, studies and patents.
TIB AV portal
In the TIB AV-Portal, audiovisual media from science and teaching can be foundand own scientific videos can be published.
Specialised Information Service for Mobility and Transport Research (FID move)
Open Research Knowledge Graph (ORKG)
The FID move can be used to search for subject-specific literature, research data and other information from mobility and transport research.
The Open Research Knowledge Graph provides structured descriptions of research content and makes it comparable.
Common Union Catalogue (GVK)
Freely accessible part of the collaborative K10plus catalogue with materials relevant for interlibrary loan and direct delivery services.