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Application

Discovery Studio 0.693731816979635 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.09806629834254144 Amorphous Cell 0.1270718232044199 Antibody 0.0 Blends 0.0027624309392265192 CASTEP 0.6634438305709024 CDOCKER 0.24861878453038674 CHARMm 0.26335174953959484 COMPASS 0.30340699815837935 COMPASS III 0.01565377532228361 COSMOconf 4.6040515653775324E-4 COSMOperm 0.0 COSMOquick 4.6040515653775324E-4 COSMOtherm 0.037753222836095765 Catalyst 0.26795580110497236 Classical Simulations 0.889963167587477 Conformers 9.208103130755065E-4 Crystallization 0.1703499079189687 DFTB Plus 0.006906077348066298 DMol3 0.35451197053406996 DPD 0.010128913443830571 Discover 0.03406998158379374 Forcite 0.358195211786372 GULP 0.03360957642725598 LUDI 0.010128913443830571 LibDock 0.04834254143646409 LigandFit 0.034530386740331494 MCSS 0.003683241252302026 MODELER 0.143646408839779 MesoDyn 0.004143646408839779 Mesocite 0.0032228360957642726 Mesoscale 0.016574585635359115 Morphology 0.01979742173112339 ONETEP 4.6040515653775324E-4 Polymorph 0.0050644567219152855 QMERA 9.208103130755065E-4 QSAR 0.0023020257826887663 Quantum Mechanics 1.0 Reflex 0.13627992633517497 Reflex Plus 0.01151012891344383 Semi-empirical 0.01841620626151013 Sorption 0.04419889502762431 Synthia 0.0023020257826887663 TURBOMOLE 4.6040515653775324E-4 VAMP 0.009668508287292817 Visualization 0.6648250460405156 X-Cell 0.004604051565377533 ZDOCK 0.0050644567219152855

Year

2003 0.0 2004 0.016094420600858368 2005 0.017167381974248927 2006 0.033261802575107295 2007 0.03755364806866953 2008 0.06330472103004292 2009 0.09871244635193133 2010 0.11051502145922747 2011 0.1298283261802575 2012 0.16416309012875535 2013 0.31008583690987124 2014 0.3293991416309013 2015 0.37339055793991416 2016 0.3959227467811159 2017 0.5064377682403434 2018 0.5257510729613734 2019 0.5504291845493562 2020 0.5697424892703863 2021 0.5311158798283262 2022 1.0 2023 0.6384120171673819 2024 0.5171673819742489 2025 0.157725321888412 2026 0.03969957081545064

Keywords

synthesized 1.0 target 0.9724054147865324 synthesis 0.29451579312738635 novel 0.199583477959042 docking 0.14821242624088857 compound 0.1391877820201319 potential 0.12460951058660187 visualization 0.097709128774731 between 0.09666782367233599 activity 0.08208955223880597 analysis 0.07323845886844846 designed 0.06907323845886845 experimental 0.06837903505727178 design 0.048247136410968415 energy 0.03609857688302673 well 0.026553280111072546 x-ray 0.026379729260673376 potent 0.025859076709475876 promising 0.023429364803887538 binding 0.0199583477959042 chemical 0.01874349184311003 inhibition 0.014578271433530025 vitro 0.0064213814647691774 cell 0.0052065255119750084 crystal 0.0
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