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Molecular Science

All about modelling and simulation at molecular level, software, databases, scripts, people, papers and so on.

Categories: Education/Reference, Information Technology
Topics: molecular science

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fau-chemie.de

fau-chemie.de fau-chemie.de           
FAU Chemie / Molecular Science :: Index
FAU Chemie / Molecular Science :: Index




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iqmol.org

iqmol.org iqmol.org           
IQmol Molecular Viewer
IQmol Molecular Viewer


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vaspkit.com

vaspkit.com vaspkit.com           
Overview — vaspkit 1.2 documentation
Overview — vaspkit 1.2 documentation


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cohp.de

cohp.de cohp.de           
COHP Homepage
COHP - Crystal Orbital Hamiltonian Population Analysis


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joaquinbarroso.com

joaquinbarroso.com joaquinbarroso.com           
Dr. Joaquin Barroso's Blog - Scientific log of a computational chemist - "Make like a molecule and React!"
Scientific log of a computational chemist - "Make like a molecule and React!"


Moz DA: 21 Moz Rank: 3.6 Semrush Rank: 11,820,363
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sobereva.com

sobereva.com sobereva.com           
思想家公社的门口:量子化学·分子模拟·二次元
本博客文章皆为原创,版权归作者Sobereva所有,所有文章从未向任何个人或组织授权转载过,严禁任何人以任何形式转载文章内容(但非常欢迎转发文章链接)!将本博客图片、文字挪作商业用途者将追究法律责任!北京科音自然科学研究中心(www.keinsci.com)旗下高水平计算化学交流论坛“计算化学公社”:bbs.keinsci.com。思想家公社QQ群专供讨论理论、计算化学,1号群18616395,2号群466017436(讨论范畴相同)。验证信息必须注明具体研究方向,否则一概不批。研究方向和理论、计算化学无关者不要加,免得浪费宝贵的空位!)。Sobereva的硬件资料库:http://sobereva.com/datasheet.rar


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aim2000.de

aim2000.de aim2000.de           
AIM2000
A program to analyse the properties of atomes in molecules by the theory of R. Bader


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cylview.org

cylview.org cylview.org           
CYLview Visualization Software
CYLview Visualization Software - Creating high quality 3D representations has never been so easy



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quantumchemistry.net

quantumchemistry.net quantumchemistry.net           




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comporgchem.com

comporgchem.com comporgchem.com           
Computational Organic Chemistry by Steven M. Bachrach
The supplemental website to Steven Bachrach's book Computational Organic Chemistry



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click2drug.org

click2drug.org click2drug.org           
Directory of in silico Drug Design tools
Directory of in silico drug design tools


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q4md-forcefieldtools.org

q4md-forcefieldtools.org q4md-forcefieldtools.org           
Apache2 Debian Default Page: It works



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q-chem.com

q-chem.com q-chem.com           
Q-Chem 6.0 Coming Soon: Quantum Chemistry Software for Efficient Molecular Modeling | Q-Chem
Q-Chem: Chemistry software, theoretical chemistry and quantum chemistry software for research, visualization, quantum calculation and molecular modeling



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atztogo.github.io

atztogo.github.io atztogo.github.io           
Research — Atsushi Togo documentation
Research — Atsushi Togo documentation


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keinsci.com

keinsci.com keinsci.com           
北京科音自然科学研究中心
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cazypedia.org

cazypedia.org cazypedia.org           
CAZypedia
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nwchem-sw.org

nwchem-sw.org nwchem-sw.org           
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Main Page - NWChem


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somewhereville.com

somewhereville.com somewhereville.com           
welcome to somewhereville (.com) - population 1; Damian G. Allis, Ph.D. residing
population 1; Damian G. Allis, Ph.D. residing


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molssi.org

molssi.org molssi.org           
MolSSI - The Molecular Sciences Software Institute
MolSSI - The Molecular Sciences Software Institute


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