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Application

Discovery Studio 0.948159509202454 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.05961960497439649 Amorphous Cell 0.2787125091441112 Blends 0.0021945866861741038 CASTEP 0.3024871982443306 CDOCKER 0.16093635698610095 CHARMm 0.260424286759327 COMPASS 0.34308705193855155 COMPASS III 0.10936356986100951 COSMObase 0.004754937820043892 COSMOconf 0.005486466715435259 COSMOmic 0.0 COSMOperm 7.31528895391368E-4 COSMOplex 3.65764447695684E-4 COSMOquick 3.65764447695684E-4 COSMOtherm 0.06364301389904901 Catalyst 0.07059253840526701 Classical Simulations 1.0 Conformers 3.65764447695684E-4 Crystallization 0.07717629846378932 DFTB Plus 0.0032918800292611556 DMol3 0.14045354791514264 DPD 0.0021945866861741038 Discover 0.004023408924652524 Forcite 0.5270665691294806 GULP 0.013533284564740308 Kinetix 0.0 LUDI 0.002926115581565472 LibDock 0.06474030724213606 LigandFit 0.0032918800292611556 MODELER 0.23994147768836868 Mesocite 0.0032918800292611556 Mesoscale 0.005120702267739576 Morphology 0.017922457937088514 ONETEP 7.31528895391368E-4 Polymorph 0.0021945866861741038 QMERA 3.65764447695684E-4 QSAR 0.0 Quantum Mechanics 0.4352596927578639 Reflex 0.055596196049743966 Reflex Plus 3.65764447695684E-4 Semi-empirical 0.004754937820043892 Sorption 0.060351133869787854 Synthia 7.31528895391368E-4 TURBOMOLE 0.0 VAMP 3.65764447695684E-4 Visualization 0.6506949524506218 X-Cell 0.0018288222384784199 ZDOCK 0.0274323335771763

Year

2024 0.05377906976744186 2025 0.9427325581395349 2026 1.0 2027 0.0

Keywords

target 1.0 potential 0.32158847576406463 analysis 0.22951138796963208 docking 0.22114074362468367 visualization 0.16137823632470313 between 0.13957562779832586 promising 0.09635974304068523 novel 0.09246642008954643 energy 0.0786451236130037 binding 0.07728246058010511 cell 0.06735448705470119 stability 0.04749854000389332 performance 0.04730387385633638 activity 0.04594121082343781 strong 0.034261241970021415 including 0.029589254428654857 enhanced 0.021997274673934204 strategy 0.019661280903250925 effective 0.018687950165466226 development 0.017130620985010708 mechanism 0.016935954837453766 synthesized 0.013431964181428849 experimental 0.008370644344948414 design 0.002725326065797158 interaction 0.0
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