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Application

Discovery Studio 1.0 Materials Studio 0.9880770628862232 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06666025394382455 Amorphous Cell 0.2795305886879569 Blends 0.0024047710657945365 CASTEP 0.39245863793766833 CDOCKER 0.16919969218930359 CHARMm 0.259234320892651 COMPASS 0.36177375913813004 COMPASS III 0.08243555213543671 COSMObase 0.003559061177375914 COSMOconf 0.004136206233166602 COSMOmic 9.619084263178146E-5 COSMOperm 0.0013466717968449403 COSMOplex 2.8857252789534437E-4 COSMOquick 0.0014428626394767218 COSMOtherm 0.06454405540592535 Cantera 0.0 Catalyst 0.12341285109657561 Classical Simulations 1.0 Conformers 6.733358984224702E-4 Crystallization 0.07291265871489035 DFTB Plus 0.0061562139284340135 DMol3 0.1763178145440554 DPD 0.0030781069642170067 Discover 0.003847633705271258 Forcite 0.5323201231242786 GULP 0.024721046556367834 Kinetix 1.9238168526356292E-4 LUDI 0.004040015390534821 LibDock 0.07108503270488649 LigandFit 0.005194305502116198 MCSS 6.733358984224702E-4 MODELER 0.1934397845325125 MesoDyn 0.0014428626394767218 Mesocite 0.004136206233166602 Mesoscale 0.007599076567910735 Modules 0.0 Morphology 0.01731435167372066 ONETEP 0.001058099268949596 Polymorph 0.002116198537899192 QMERA 1.9238168526356292E-4 QSAR 0.001250480954213159 Quantum Mechanics 0.5579068872643325 Reflex 0.05300115429011158 Reflex Plus 8.657175836860331E-4 Semi-empirical 0.008080030781069641 Sorption 0.05492497114274721 Synthia 0.0015390534821085034 TURBOMOLE 5.771450557906887E-4 VAMP 0.0015390534821085034 Visualization 0.8466717968449403 X-Cell 0.0013466717968449403 ZDOCK 0.029434397845325123

Year

2021 0.031236134528352118 2022 0.14917029017659064 2023 0.3341024048274026 2024 0.713994143224776 2025 1.0 2026 0.3771408288224332 2027 0.0

Keywords

target 1.0 potential 0.2782373726875909 docking 0.2237788401579713 visualization 0.20739970900020785 analysis 0.19014757846601538 between 0.15472874662232383 novel 0.1020993556433174 energy 0.08522136769902307 binding 0.07279151943462897 cell 0.062149241321970486 promising 0.056744959467886096 activity 0.05416753273747662 interaction 0.037331116192059866 stability 0.03521097484930368 synthesized 0.031053834961546456 experimental 0.03022240698399501 performance 0.0251506963209312 protein 0.020827270837663687 development 0.020453128247765538 effective 0.019455414674703804 mechanism 0.019289129079193515 including 0.015880274371232593 synthesis 0.013760133028476408 design 0.002909997921430056 chemical 0.0
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