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Application

Discovery Studio 0.8587171517377791 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.1109460128776622 Amorphous Cell 0.14759782070331848 Blends 0.0029717682020802376 CASTEP 0.6285289747399703 CDOCKER 0.2585438335809807 CHARMm 0.3006438831104507 COMPASS 0.34175334323922735 COMPASS III 0.02526002971768202 COSMOconf 0.0 COSMOmic 4.952947003467063E-4 COSMOperm 0.0 COSMOquick 0.0 COSMOtherm 0.037642397226349676 Catalyst 0.2976721149083705 Classical Simulations 1.0 Conformers 9.905894006934125E-4 Crystallization 0.17186726102030708 DFTB Plus 0.0079247152055473 DMol3 0.3229321446260525 DPD 0.007429420505200594 Discover 0.030212976721149084 Forcite 0.42050520059435365 GULP 0.032194155522535906 LUDI 0.0079247152055473 LibDock 0.05894006934125805 LigandFit 0.02526002971768202 MCSS 0.0014858841010401188 MODELER 0.13719663199603765 MesoDyn 0.001981178801386825 Mesocite 4.952947003467063E-4 Mesoscale 0.010401188707280832 Morphology 0.02129767211490837 ONETEP 4.952947003467063E-4 Polymorph 0.004457652303120356 QMERA 0.0 QSAR 0.003467062902426944 Quantum Mechanics 0.9336305101535414 Reflex 0.1406636948984646 Reflex Plus 0.007429420505200594 Semi-empirical 0.016840019811788013 Sorption 0.05250123823675087 Synthia 0.0024764735017335313 TURBOMOLE 4.952947003467063E-4 VAMP 0.0079247152055473 Visualization 0.8900445765230312 X-Cell 0.005943536404160475 ZDOCK 0.005943536404160475

Year

2001 0.0011198208286674132 2002 0.004479283314669653 2003 0.0033594624860022394 2004 0.004479283314669653 2005 0.010078387458006719 2006 0.02127659574468085 2007 0.025755879059350503 2008 0.0335946248600224 2009 0.0425531914893617 2010 0.0593505039193729 2011 0.09518477043673013 2012 0.1433370660694289 2013 0.1623740201567749 2014 0.21612541993281076 2015 0.26763717805151177 2016 0.284434490481523 2017 0.3404255319148936 2018 0.3840985442329227 2019 0.48600223964165734 2020 0.5375139977603584 2021 0.5979843225083986 2022 0.7178051511758119 2023 0.8768197088465846 2024 1.0 2025 0.9025755879059351 2026 0.3516237402015677 2027 0.0

Keywords

synthesized 1.0 target 0.963013698630137 synthesis 0.30633561643835616 novel 0.21575342465753425 docking 0.20787671232876712 potential 0.16575342465753426 compound 0.14982876712328766 visualization 0.14263698630136987 activity 0.09452054794520548 between 0.08972602739726028 analysis 0.0875 designed 0.06592465753424658 design 0.0589041095890411 experimental 0.052054794520547946 promising 0.04452054794520548 binding 0.04160958904109589 potent 0.03339041095890411 vitro 0.026883561643835617 inhibition 0.024143835616438358 energy 0.020719178082191782 cell 0.013527397260273973 well 0.004794520547945206 chemical 0.003595890410958904 active 1.7123287671232877E-4 x-ray 0.0
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