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the Walker Molecular Dynamics lab - Main

Video extract from the NVIDIA GTC 2010 Conference in San Jose, CA. The Walker Molecular Dynamics Lab's work on accelerating the AMBER Molecular Dynamics package with GPUs is featured in the keynote speech by the CEO of NVIDIA. Click here to download the video if the above player does not work. The research focus of the Walker Molecular Dynamics (. Http:/ www.wmd-lab.org. Based at the San Diego. The lab is also closely involved with the development of the.

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the Walker Molecular Dynamics lab - Main | wmd-lab.org Reviews

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Video extract from the NVIDIA GTC 2010 Conference in San Jose, CA. The Walker Molecular Dynamics Lab's work on accelerating the AMBER Molecular Dynamics package with GPUs is featured in the keynote speech by the CEO of NVIDIA. Click here to download the video if the above player does not work. The research focus of the Walker Molecular Dynamics (. Http:/ www.wmd-lab.org. Based at the San Diego. The lab is also closely involved with the development of the.

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4 publications

5 links

6 positions

7 walker molecular dynamics

8 what we do

9 amber

10 coupons

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the Walker Molecular Dynamics lab - Main | wmd-lab.org Reviews

https://wmd-lab.org

Video extract from the NVIDIA GTC 2010 Conference in San Jose, CA. The Walker Molecular Dynamics Lab's work on accelerating the AMBER Molecular Dynamics package with GPUs is featured in the keynote speech by the CEO of NVIDIA. Click here to download the video if the above player does not work. The research focus of the Walker Molecular Dynamics (. Http:/ www.wmd-lab.org. Based at the San Diego. The lab is also closely involved with the development of the.

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wmd-lab.org

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the Walker Molecular Dynamics lab - Publications

http://www.wmd-lab.org/publications.htm

Madej, B., Gould, I.R., Walker, R.C., "A Parameterization of Cholesterol for Mixed Lipid Bilayer Simulation within the Amber Lipid14 Force Field, J. Phys. Chem. B., 2015, in press. Hopkins C.W., Le Grand, S., Walker, R.C., Roitberg, A.E., "Long Time Step Molecular Dynamics through Hydrogen Mass Repartitioning", J. Chem. Theory. Comput., 2015, 11 (4), 1864-1874, DOI: 10.1021/ct5010406. 51, 4402, DOI: 10.1039/C4CC09584G. Mones, L., Jones, A., Goetz, A.W., Laino, T., Walker, R.C....Betz, R.M., Walke...9, 16...

2

the Walker Molecular Dynamics lab - Members

http://www.wmd-lab.org/members.htm

Oct 2014 (from left):. Back: Ben Madej, Keshav Tadimete, Ross Walker, Andreas Goetz, Perri Needham. Front: Longhua Yang, Mariarosaria Ferraro, Age Skjevik. Dr Needham is a NSF funded postdoctoral research associate working on advanced molecular dynamics simulations. Her specific focus is on GPU accelerated molecular dynamics as well as Intel funded work to explore the use of Intel Many Integrated Core technologies to accelerate molecular dynamics within the AMBER software package. Ben is a graduate of th...

3

the Walker Molecular Dynamics lab - Links

http://www.wmd-lab.org/links.htm

Http:/ www.rosswalker.co.uk/. Http:/ www.awgoetz.de/. The AMBER Molecular Dynamics Package. AMBER MD Tutorial Suite. The VMD Visualization Package. Http:/ www.ks.uiuc.edu/Research/vmd/. AMBER Certified GPU Computing Solutions. Http:/ exxactcorp.com/index.php/solution/solu list/65. Exxact Certified GPU Life Science Solutions. Http:/ www.exxactcorp.com/newproducts/Certified-Life-Science-GPU-Systems/. Digits Dev Box and Deep Learning Dev Box. Http:/ exxactcorp.com/deep-learning-overview.php.

4

the Walker Molecular Dynamics lab - Positions

http://www.wmd-lab.org/positions.htm

Currently there are openings in the lab for:. There are no positions available at this time. However, if you have your own funding and would like to join the lab, or are applying for funding and would like sponsorship of your application please contact Prof. Ross C. Walker (rcw at sdsc.edu). Internship students should be registered undergraduates at a U.S. institution, be either U.S. Citizens, Permanent Residents or have USCIS authorization to work during summer recess.

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chem.ucsd.edu

UCSD Chemistry and Biochemistry Adjunct Faculty

http://www.chem.ucsd.edu/faculty/adjunct.html

By grad program tracks. Tutor and Reader Opportunities. CHEM 6 Help Room. Office of Postdoctoral and Visiting Scholar Affairs. EHS - My Research Safety. Adjunct Professor of Chemistry and Biochemistry. CEO, Tioga Research, Inc. CEO, Bio4Front, Inc. Skin structure and properties, High throughput experimentation, Computational Modeling, Entrepreneurship. Office: Urey Hall Addn. Web: www.linkedin.com/pub/john-m-newsam/1/164/977. Adjunct Professor of Chemistry and Biochemistry. Office: SDSC Addn/East E397.

www-chem.ucsd.edu

UCSD Chemistry and Biochemistry Adjunct Faculty

http://www-chem.ucsd.edu/faculty/adjunct.html

By grad program tracks. Tutor and Reader Opportunities. CHEM 6 Help Room. Office of Postdoctoral and Visiting Scholar Affairs. EHS - My Research Safety. Adjunct Professor of Chemistry and Biochemistry. CEO, Tioga Research, Inc. CEO, Bio4Front, Inc. Skin structure and properties, High throughput experimentation, Computational Modeling, Entrepreneurship. Office: Urey Hall Addn. Web: www.linkedin.com/pub/john-m-newsam/1/164/977. Adjunct Professor of Chemistry and Biochemistry. Office: SDSC Addn/East E397.

ambermd.org

Amber (PMEMD) NVIDIA GPU Support

http://ambermd.org/gpus

AMBER 16 NVIDIA GPU. Running GPU Accelerated Simulations. Considerations for Maximizing GPU Performance. Recommended Hardware and Test Drives. Return to Main Amber Page. This page describes AMBER 16 GPU support. If you are using AMBER 14 please see the archived AMBER 14 page here. Aug 2016: Titan-XP [aka Pascal Titan-X] released and supported by Amber 16 on day of launch. Fastest ever MD performance on commodity hardware observed. Update.6 released for AmberTools 16 - adds support for GTX-1080. If you wa...

robinbetz.com

About - Robin M. Betz

http://www.robinbetz.com/about

Robin M. Betz. I am a graduate student in biophysics at Stanford University. I am a member of the Ron Dror group. I graduated from UC San Diego in March 2014 with a major in Bioinformatics. And a minor in Mathematics. I have done computational chemistry at the San Diego Supercomputer Center. As part of the Walker Molecular Dynamics Lab. Since 2011. I have also worked at Pfizer. The National Oceanic and Atmospheric Administration. And the UCSD Experimental Game Lab. On the weekends in Monterey Bay. I ...

chem-web.ucsd.edu

UCSD Chemistry and Biochemistry Adjunct Faculty

http://chem-web.ucsd.edu/faculty/adjunct.html

By grad program tracks. Tutor and Reader Opportunities. CHEM 6 Help Room. Office of Postdoctoral and Visiting Scholar Affairs. EHS - My Research Safety. Adjunct Professor of Chemistry and Biochemistry. CEO, Tioga Research, Inc. CEO, Bio4Front, Inc. Skin structure and properties, High throughput experimentation, Computational Modeling, Entrepreneurship. Office: Urey Hall Addn. Web: www.linkedin.com/pub/john-m-newsam/1/164/977. Adjunct Professor of Chemistry and Biochemistry. Office: SDSC Addn/East E397.

rosswalker.co.uk

About Me

http://www.rosswalker.co.uk/mainframe1.htm

Associate Research Professor &. High Performance Computing Consultant. San Diego Supercomputer Center &amp. Leader: Walker Molecular Dynamics Lab. My Curriculum Vitae is available here. The Walker Molecular Dynamics Lab is here. San Diego Supercomputer Center. University of California San Diego. 9500 Gilman Drive #0505. La Jolla, CA, 92093-0505. 1 (858) 822 0854. Ross 'at' rosswalker.co.uk. Exxact NVIDIA Digits Deep Learning Dev Boxes. 4 GPU, 8 GPU and 10 GPU NVIDIA Digits Dev Box. DGX-1. My interests li...

chemistry.ucsd.edu

UCSD Chemistry and Biochemistry Adjunct Faculty

http://chemistry.ucsd.edu/faculty/adjunct.html

By grad program tracks. Tutor and Reader Opportunities. CHEM 6 Help Room. Office of Postdoctoral and Visiting Scholar Affairs. EHS - My Research Safety. Adjunct Professor of Chemistry and Biochemistry. CEO, Tioga Research, Inc. CEO, Bio4Front, Inc. Skin structure and properties, High throughput experimentation, Computational Modeling, Entrepreneurship. Office: Urey Hall Addn. Web: www.linkedin.com/pub/john-m-newsam/1/164/977. Adjunct Professor of Chemistry and Biochemistry. Office: SDSC Addn/East E397.

ambermd.org

Amber (PMEMD) NVIDIA GPU Support

http://ambermd.org/gpus/index.htm

AMBER 16 NVIDIA GPU. Running GPU Accelerated Simulations. Considerations for Maximizing GPU Performance. Recommended Hardware and Test Drives. Return to Main Amber Page. This page describes AMBER 16 GPU support. If you are using AMBER 14 please see the archived AMBER 14 page here. Aug 2016: Titan-XP [aka Pascal Titan-X] released and supported by Amber 16 on day of launch. Fastest ever MD performance on commodity hardware observed. Update.6 released for AmberTools 16 - adds support for GTX-1080. If you wa...

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wmd-lab.org

the Walker Molecular Dynamics lab - Main

Video extract from the NVIDIA GTC 2010 Conference in San Jose, CA. The Walker Molecular Dynamics Lab's work on accelerating the AMBER Molecular Dynamics package with GPUs is featured in the keynote speech by the CEO of NVIDIA. Click here to download the video if the above player does not work. The research focus of the Walker Molecular Dynamics (. Http:/ www.wmd-lab.org. Based at the San Diego. The lab is also closely involved with the development of the.

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