Theoretical chemistry - PDFSEARCH.IO - Document Search Engine

Theoretical chemistry
Results: 969

#	Item
271	5th South African HIV Drug Resistance & Treatment Monitoring Workshop The workshop involves theoretical lectures and practical sessions on the usage and interpretation of HIV-1 drug resistance genotyping in the managemen Add to Reading List Source URL: www.fidssa.co.za Language: English - Date: 2010-09-29 05:28:28 Antiretroviral drug Zidovudine Medicine Chemistry Health HIV/AIDS HIV drug resistance Pharmacology
272	Chemical Physics Letters–321 www.elsevier.com/locate/cplett Linear regression correction to ﬁrst principle theoretical calculations – Improved descriptors and enlarged training set Xue-Mei Duan a, Zh Add to Reading List Source URL: yangtze.hku.hk Language: English - Date: 2010-12-19 08:35:07 Theoretical chemistry Chemical bonding Computational chemistry Atomic physics Hybrid functional Density functional theory Electronic correlation Basis set Resonance Chemistry Physics Quantum chemistry
273	Copyright © 2006 American Scientiﬁc Publishers All rights reserved Printed in the United States of America Journal of Computational and Theoretical Nanoscience Add to Reading List Source URL: yangtze.hku.hk Language: English - Date: 2010-12-19 08:35:06 Density functional theory Computational chemistry Computational physics Quantum chemistry Theoretical chemistry Hybrid functional Hartree–Fock method Time-dependent density functional theory Crystal Chemistry Physics Quantum mechanics
274	Chemical Physics Letters–149 www.elsevier.com/locate/cplett Theoretical interpretation of diﬀerent nanotube morphologies among Group III (B, Al, Ga) nitrides Min Zhang a, Zhong-Min Su a,, Li-Kai Yan a Add to Reading List Source URL: yangtze.hku.hk Language: English* - Date: 2010-12-19 08:35:09 Borazine Crystal Wurtzite crystal structure Benzene Nanowire Boron nitride Optical properties of carbon nanotubes Chemistry Emerging technologies Carbon nanotubes
275	BioMed Research International Special Issue on Theoretical and Experimental Advances in Understanding Biomolecular Dynamics, Interactions, and Allostery Add to Reading List Source URL: downloads.hindawi.com Language: English - Date: 2014-12-15 08:01:03 Science Protein structure Molecular modelling Proteomics Proteins Protein–protein interaction Molecular dynamics Interactome Biophysics Biology Bioinformatics Chemistry
276	JOURNAL OF CHEMICAL PHYSICS VOLUME 121, NUMBEROCTOBER 2004 Add to Reading List Source URL: yangtze.hku.hk Language: English - Date: 2010-12-19 08:35:06 Computational chemistry Quantum chemistry Atomic physics Density functional theory Hybrid functional Hartree–Fock method Basis set Ab initio quantum chemistry methods Electronic correlation Chemistry Physics Theoretical chemistry
277	COMMUNICATIONS IN COMPUTATIONAL PHYSICS Vol. 1, No. 1, ppCommun. Comput. Phys. February 2006 Add to Reading List Source URL: www.phy.cuhk.edu.hk Language: English - Date: 2006-04-28 22:43:01 Quantum chemistry Numerical linear algebra Theoretical physics Mathematical physics Density matrix renormalization group Hubbard model Krylov subspace Quantum Monte Carlo Heisenberg model Physics Algebra Statistical mechanics
278	THE JOURNAL OF CHEMICAL PHYSICS 133, s2010d Time-dependent density functional theory for quantum transport Xiao Zheng,1,2 GuanHua Chen,2,3,4,a! Yan Mo,1,2,5 SiuKong Koo,2 Heng Tian,2 ChiYung Yam,2 and YiJing Yan1 Add to Reading List Source URL: yangtze.hku.hk Language: English - Date: 2010-12-19 08:35:07 Computational physics Computational chemistry Density functional theory Quantum chemistry Theoretical chemistry Time-dependent density functional theory Electronic band structure Types of radio emissions ABO blood group system Chemistry Physics Science
279	EMSL Research and Capability Development Proposals Molecular-scale Visualization of Ligand Conformation on Functionalized Nanoparticles: A Combination of Experimental and Theoretical Studies Project start date: July 2010 Add to Reading List Source URL: www.emsl.pnl.gov Language: English - Date: 2015-03-24 18:38:01 Environmental Molecular Sciences Laboratory Richland Washington Tri-Cities Washington United States Department of Energy National Laboratories Nanoparticle Ligand Cerium(IV) oxide Janus particles Chemistry Nanomaterials Nanotechnology
280	Early Experiences Scaling VMD Molecular Visualization and Analysis Jobs on Blue Waters John E. Stone, Barry Isralewitz, Klaus Schulten Theoretical and Computational Biophysics Group Beckman Institute for Advanced Science Add to Reading List Source URL: www.ks.uiuc.edu Language: English - Date: 2013-10-18 12:01:40 Visual Molecular Dynamics Molecular modelling NAMD Computational chemistry Beckman Institute University of Illinois at Urbana–Champaign Urbana Illinois Molecular dynamics Bioinformatics Science Champaign County Illinois Application software

UPDATE