GROMACS

Results: 18



#Item
11Theoretical chemistry / Drug discovery / Medicinal chemistry / Computational chemistry / Protein structure / Docking / AutoDock / CHARMM / GROMACS / Chemistry / Science / Molecular modelling

NORTHERN REGION Pharmaceutical Design and Simulation Laboratory School of Pharmaceutical Sciences Universiti Sains Malaysia (USM) Specialises in computational chemistry, rational drug design

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Source URL: www.biotechcorp.com.my

Language: English - Date: 2013-12-02 11:47:20
12Computational chemistry / Molecular modelling / Operations research / Simulation / GROMACS / Biomedical scientist / Molecular dynamics / CHARMM / Physics Abstraction Layer / Science / Chemistry / Medicine

National Center for Simulation of Physics-Based Simulation of Biological Structures

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Source URL: commonfund.nih.gov

Language: English - Date: 2014-04-28 15:04:38
13Computer programming / Source code / Peer review / Software quality / Systems engineering / Code review / GROMACS / Software development process / Software bug / Software review / Software engineering / Science

Modern Code Reviews in Open-Source Projects: Which Problems Do They Fix? Moritz Beller, Alberto Bacchelli, Andy Zaidman Elmar Juergens

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Source URL: www.st.ewi.tudelft.nl

Language: English - Date: 2014-05-11 17:54:40
14ACEnet / Atlantic Canada / Consortia / Parallel computing / NAMD / ABINIT / OpenFOAM / Computer cluster / GROMACS / Science / Computing / Application software

ACEnet: Free Cluster Computing For Researchers Dr. Ross Dickson, Computational Research Consultant What is ACEnet?

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Source URL: www.ace-net.ca

Language: English - Date: 2014-05-06 13:40:06
15Computational chemistry / Molecular modelling / Operations research / Simulation / GROMACS / Biomedical scientist / Molecular dynamics / CHARMM / Physics Abstraction Layer / Science / Chemistry / Medicine

National Center for Simulation of Physics-Based Simulation of Biological Structures

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Source URL: commonfund.nih.gov

Language: English - Date: 2014-04-28 15:04:38
16Molecular modelling / Biology / Computational chemistry / Root-mean-square deviation / Protein folding / Molten globule / Molecular dynamics / Random coil / GROMACS / Chemistry / Protein structure / Statistics

Kinetics and Thermodynamics in the Folding of Trp-Cage: Simulation by Parallel-Tempering∗ Jia-Lin Lo1,2 , Chun-Ping Yu1,2 and Hoong-Chien Lee1−3†

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Source URL: sansan.phy.ncu.edu.tw

Language: English - Date: 2005-04-19 07:50:33
17Molecular modelling / Intermolecular forces / Water / Water model / OPLS / Force field / CHARMM / GROMACS / Sodium chloride / Chemistry / Computational chemistry / Force fields

PDF Document

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Source URL: www.apmaths.uwo.ca

Language: English - Date: 2007-01-21 06:30:04
18Molecular modelling / Computational chemistry / Protein structure / Bioinformatics / Folding@home / Protein folding / Molecular dynamics / GROMACS / FLOPS / Chemistry / Software / Science

PDF Document

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Source URL: biochem218.stanford.edu

Language: English - Date: 2010-06-09 14:06:47
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