<--- Back to Details
First PageDocument Content
Molecular modelling / Protein structure / Drug discovery / Medicinal chemistry / Docking / Drug design / Ligand / Implicit solvation / Molecular mechanics / Chemistry / Science / Computational chemistry
Date: 2013-08-26 16:18:20
Molecular modelling
Protein structure
Drug discovery
Medicinal chemistry
Docking
Drug design
Ligand
Implicit solvation
Molecular mechanics
Chemistry
Science
Computational chemistry

Add to Reading List

Source URL: media.wiley.com

Download Document from Source Website

File Size: 61,09 KB

Share Document on Facebook

Similar Documents

Chemistry / Solutions / Molecular modelling / Intermolecular forces / Physical chemistry / Metal ions in aqueous solution / Acids / Solvation shell / Properties of water / Implicit solvation / Hydrogen bond / Solvation

2108 J. Chem. Theory Comput. 2008, 4, 2108–2121 Explaining Asymmetric Solvation of Pt(II) versus Pd(II) in Aqueous Solution Revealed by Ab Initio Molecular

DocID: 1qQlF - View Document

Chemistry / Laboratory techniques / Physical chemistry / Partial differential equations / Lamm equation / Solution / Least squares / Regularization / Inverse problem / Implicit solvation

Parsimonious Regularization using Genetic Algorithms Applied to the Analysis of Analytical Ultracentrifugation Experiments Emre H Brookes Borries Demeler

DocID: 1qIix - View Document

Solutions / Computational chemistry / Molecular modelling / Physical chemistry / Ions / Ionic liquid / Solvation / Molecular dynamics / Solvent / Implicit solvation / Solvent models

FAKULTÄT FÜR CHEMIE Einladung zum Vortrag von ___________________________________________________________________ Ass.-Prof. Dipl.-Chem. Dr. Christian Schröder

DocID: 1puiz - View Document

Computational chemistry / Molecular modelling / Proteins / Hydrophobic effect / Protein folding / Hydrophobe / Implicit solvation / GroEL / Hydrophobic collapse / Chemistry / Protein structure / Intermolecular forces

359 Charge, hydrophobicity, and confined water: putting past simulations into a simple theoretical framework1

DocID: 1gGbX - View Document

Biology / Protein folding / Energy landscape / Molecular dynamics / Folding funnel / Protein structure prediction / Lattice protein / Protein domain / Implicit solvation / Protein structure / Chemistry / Science

Emergent organisation in complex biomolecular systems EMBIO Activity code addressed: NEST-2003-Path-1 Abstract Complexity and self-organisation are critical yet poorly understood phenomena. This project aims to develop a

DocID: 1fNpe - View Document