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Application

Discovery Studio 1.0 Materials Studio 0.8200772200772201 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.0639686684073107 Amorphous Cell 0.11096605744125326 Blends 0.005221932114882507 CASTEP 0.5535248041775457 CDOCKER 0.2506527415143603 CHARMm 0.4425587467362924 COMPASS 0.24151436031331594 COMPASS III 0.016971279373368148 COSMObase 0.0 COSMOconf 0.0 COSMOquick 0.0026109660574412533 COSMOtherm 0.0835509138381201 Catalyst 0.33550913838120106 Classical Simulations 1.0 Conformers 0.0013054830287206266 Crystallization 0.07180156657963446 DFTB Plus 0.0026109660574412533 DMol3 0.31723237597911225 DPD 0.0039164490861618795 Discover 0.01174934725848564 Forcite 0.28067885117493474 GULP 0.08746736292428199 LUDI 0.04699738903394256 LibDock 0.0835509138381201 LigandFit 0.1122715404699739 MCSS 0.0039164490861618795 MODELER 0.4151436031331593 MesoDyn 0.0013054830287206266 Mesocite 0.005221932114882507 Mesoscale 0.01174934725848564 Morphology 0.013054830287206266 ONETEP 0.0026109660574412533 Polymorph 0.0026109660574412533 QSAR 0.0 Quantum Mechanics 0.8590078328981723 Reflex 0.05221932114882506 Reflex Plus 0.0026109660574412533 Semi-empirical 0.007832898172323759 Sorption 0.02741514360313316 TURBOMOLE 0.0 VAMP 0.0039164490861618795 Visualization 0.7924281984334204 X-Cell 0.0 ZDOCK 0.020887728459530026

Year

2003 0.0377906976744186 2004 0.02616279069767442 2005 0.0 2006 0.014534883720930232 2007 0.023255813953488372 2008 0.11627906976744186 2009 0.2005813953488372 2010 0.20930232558139536 2011 0.14825581395348839 2012 0.061046511627906974 2013 0.5116279069767442 2014 0.43023255813953487 2015 0.21220930232558138 2016 0.11337209302325581 2017 0.19186046511627908 2018 0.4011627906976744 2019 0.23255813953488372 2020 0.9767441860465116 2021 0.6540697674418605 2022 0.6598837209302325 2023 0.42151162790697677 2024 1.0 2025 0.3633720930232558 2026 0.1569767441860465

Keywords

potential 1.0 target 0.961973743775464 docking 0.20280669986419195 analysis 0.12403802625622454 between 0.1231326392032594 visualization 0.12041647804436396 novel 0.11905839746491625 binding 0.0869171570846537 energy 0.07152557718424626 activity 0.06201901312811227 well 0.04345857854232685 protein 0.038931643277501135 chemical 0.032593933906745136 experimental 0.030330466274332276 interaction 0.026256224535989137 promising 0.023540063377093707 drug 0.021729289271163424 development 0.016296966953372568 compound 0.010864644635581712 treatment 0.010864644635581712 synthesized 0.005432322317790856 inhibition 0.003168854685377999 effective 0.0018107741059302852 active 9.053870529651426E-4 design 0.0
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