Search Result "parameterization Transition-metal chemistry"
Biomolecular Simulations of Metalloenzymes: Strategies to Tackle the Missing Parameter Problem
Journal: Current Inorganic Chemistry (Discontinued)
Volume: 2 Issue: 3 Year: 2012 Page: 254-262
Author(s): Alexandra T.P. Carvalho
Magnetic, Optical and Conduction Properties of Transition Metal Nanowires
Journal: Current Physical Chemistry
Volume: 3 Issue: 4 Year: 2013 Page: 441-450
Author(s): Y. H. Zhang,C. A. Taft,X. Q. Zhang,Hui Li
Recent Insights on the Medicinal Chemistry of Metal-Based Compounds: Hints for the Successful Drug Design
Journal: Current Medicinal Chemistry
Volume: 17 Issue: 3 Year: 2010 Page: 3739-3750
Author(s): M. Z. Hernandes, F. J.de S. Pontes, L. C.D. Coelho, D. R.M. Moreira, V. R.A. Pereira, A. C.L. Leite
Monodentate Trialkylphosphines: Privileged Ligands in Metal-catalyzed Crosscoupling Reactions
Journal: Current Organic Chemistry
Volume: 24 Issue: 3 Year: 2020 Page: 231-264
Author(s): Kevin H. Shaughnessy
MCDCalc: Markov Chain Molecular Descriptors Calculator for Medicinal Chemistry
Journal: Current Topics in Medicinal Chemistry
Volume: 20 Issue: 4 Year: 2020 Page: 305-317
Author(s): Paula Carracedo-Reboredo,Ramiro Corona,Mikel Martinez-Nunes,Carlos Fernandez-Lozano,Georgia Tsiliki,Haralambos Sarimveis,Eider Aranzamendi,Sonia Arrasate,Nuria Sotomayor,Esther Lete,Cristian Robert Munteanu,Humbert González-DÃaz
A Review of Density Functional Theory Quantum Mechanics as Applied to Pharmaceutically Relevant Systems
Journal: Current Computer-Aided Drug Design
Volume: 3 Issue: 4 Year: 2007 Page: 290-296
Author(s): Shenna M. LaPointe, Donald F. Weaver
Molecular Modeling and Cyclodextrins: A Relationship Strengthened By Complexes
Journal: Current Organic Chemistry
Volume: 10 Issue: 7 Year: 2006 Page: 715-729
Author(s): E. A. Castro, D. A. J. Barbiric
Treatment of Some Classes of PDEs and ODEs Part A: Complex Numerical Atmospheric Environmental Models - Overall Description and Applications
Ebook: Advanced Numerical Methods for Complex Environmental Models: Needs and Availability
Volume: 1 Year: 2013
Author(s): Adolf Ebel,Michael Memmesheimer
Doi: 10.2174/9781608057788113010005
Metal Oxide Nanoparticles: Size-Dependence of Quantum-Mechanical Properties
Journal: Nanoscience & Nanotechnology-Asia
Volume: 1 Issue: 1 Year: 2011 Page: 53-58
Author(s): Agnieszka Gajewicz, Tomasz Puzyn, Bakhtiyor Rasulev, Danuta Leszczynska, Jerzy Leszczynski
The Use of Density Functional Theory in Computer-Aided Drug Discovery
Ebook: Computer-Aided Drug Discovery Methods: A Brief Introduction
Volume: 1 Year: 2024
Author(s): Manos C. Vlasiou
Doi: 10.2174/9789815305036124010006