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Application

Discovery Studio 1.0 Materials Studio 0.2542037586547972 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.1079429735234216 Amorphous Cell 0.059063136456211814 CASTEP 0.02240325865580448 CDOCKER 0.35845213849287166 CHARMm 0.5906313645621182 COMPASS 0.29327902240325865 COMPASS III 0.002036659877800407 COSMOtherm 0.006109979633401222 Catalyst 0.4745417515274949 Classical Simulations 1.0 Crystallization 0.020366598778004074 DFTB Plus 0.002036659877800407 DMol3 0.10386965376782077 Discover 0.016293279022403257 Forcite 0.24439918533604887 GULP 0.002036659877800407 LUDI 0.03054989816700611 LibDock 0.08961303462321792 LigandFit 0.1446028513238289 MCSS 0.0 MODELER 0.5071283095723014 Morphology 0.002036659877800407 ONETEP 0.0 QSAR 0.002036659877800407 Quantum Mechanics 0.12830957230142567 Reflex 0.014256619144602852 Reflex Plus 0.0 Semi-empirical 0.014256619144602852 Sorption 0.004073319755600814 VAMP 0.010183299389002037 Visualization 0.7372708757637475 X-Cell 0.004073319755600814 ZDOCK 0.02240325865580448

Year

2003 0.0 2004 0.006756756756756757 2005 0.013513513513513514 2006 0.02702702702702703 2007 0.02702702702702703 2008 0.1554054054054054 2009 0.21621621621621623 2010 0.40540540540540543 2011 0.02027027027027027 2012 0.02702702702702703 2013 0.7972972972972973 2014 0.9797297297297297 2015 0.8108108108108109 2016 0.4391891891891892 2017 0.2635135135135135 2018 0.5540540540540541 2019 0.1554054054054054 2020 1.0 2021 0.5337837837837838 2022 0.9054054054054054 2023 0.27702702702702703 2024 0.7027027027027027 2025 0.14864864864864866 2026 0.02027027027027027

Keywords

inhibition 1.0 target 0.9577735124760077 docking 0.3291746641074856 potential 0.20441458733205375 activity 0.19385796545105566 inhibitor 0.15642994241842612 novel 0.14587332053742802 binding 0.12667946257197696 visualization 0.1218809980806142 vitro 0.09213051823416507 potent 0.07965451055662189 compound 0.07485604606525911 analysis 0.07389635316698656 between 0.053742802303262956 enzyme 0.04126679462571977 inhibitory 0.0345489443378119 synthesized 0.03166986564299424 synthesis 0.02783109404990403 protein 0.02495201535508637 modeler 0.011516314779270634 human 0.01055662188099808 drug 0.0067178502879078695 catalyst 0.005758157389635317 medicinal 0.003838771593090211 active 0.0
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