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Application

Discovery Studio 1.0 Materials Studio 0.6218861209964412 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.05904377880184332 Amorphous Cell 0.15351382488479262 Blends 0.0025921658986175116 CASTEP 0.41849078341013823 CDOCKER 0.3548387096774194 CHARMm 0.4602534562211982 COMPASS 0.27419354838709675 COMPASS III 0.03513824884792627 COSMObase 8.640552995391706E-4 COSMOconf 2.880184331797235E-4 COSMOmic 0.0 COSMOperm 0.0 COSMOquick 0.0020161290322580645 COSMOtherm 0.05241935483870968 Catalyst 0.37355990783410137 Classical Simulations 1.0 Conformers 0.001152073732718894 Crystallization 0.07805299539170507 DFTB Plus 0.0037442396313364054 DMol3 0.24049539170506912 DPD 0.006336405529953917 Discover 0.015264976958525345 Forcite 0.3528225806451613 GULP 0.025057603686635944 LUDI 0.020161290322580645 LibDock 0.12067972350230415 LigandFit 0.04838709677419355 MCSS 0.0037442396313364054 MODELER 0.3709677419354839 MesoDyn 0.0031682027649769587 Mesocite 0.004320276497695853 Mesoscale 0.011808755760368663 Morphology 0.01238479262672811 ONETEP 0.0017281105990783411 Polymorph 0.004032258064516129 QMERA 0.0 QSAR 0.002880184331797235 Quantum Mechanics 0.6457373271889401 Reflex 0.059907834101382486 Reflex Plus 0.001152073732718894 Semi-empirical 0.006048387096774193 Sorption 0.022753456221198155 Synthia 8.640552995391706E-4 TURBOMOLE 5.76036866359447E-4 VAMP 0.001152073732718894 Visualization 0.9075460829493087 X-Cell 0.004032258064516129 ZDOCK 0.03888248847926267

Year

2001 4.4365572315882877E-4 2002 0.0013309671694764862 2003 0.003105590062111801 2004 0.0026619343389529724 2005 0.00354924578527063 2006 0.006211180124223602 2007 0.009316770186335404 2008 0.019520851818988466 2009 0.022626441881100266 2010 0.04259094942324756 2011 0.06876663708961846 2012 0.07630878438331855 2013 0.09538598047914817 2014 0.11091393078970718 2015 0.13664596273291926 2016 0.13531499556344276 2017 0.17125110913930788 2018 0.19875776397515527 2019 0.22759538598047915 2020 0.2790594498669033 2021 0.29547471162378 2022 0.3531499556344277 2023 0.6543921916592724 2024 0.9188110026619344 2025 1.0 2026 0.2506654835847382 2027 0.0

Keywords

novel 1.0 target 0.9593949852806821 potential 0.27347477413460564 docking 0.2544919297533245 visualization 0.15450208100700435 analysis 0.14089940107603288 synthesized 0.1351131864785301 synthesis 0.10750177646939398 activity 0.10191858694548776 between 0.0918688458024566 binding 0.08790985686732311 compound 0.07816465333468683 promising 0.07359658917876358 development 0.06699827428687442 design 0.060298446858186985 drug 0.030250735965891788 protein 0.028931072987513958 potent 0.028626535377119074 vitro 0.021317632727641863 cell 0.01969343213886915 inhibition 0.018475281697289615 energy 0.009542178459039692 effective 0.009440665922241397 chemical 0.005481676987107908 interaction 0.0
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