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Application

Discovery Studio 1.0 Materials Studio 0.9931715282416685 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06591466405100539 Amorphous Cell 0.28062775870524764 Blends 0.0023540951446787643 CASTEP 0.39440902403138794 CDOCKER 0.17018146150073565 CHARMm 0.2584600294261893 COMPASS 0.3640019617459539 COMPASS III 0.08249141736145169 COSMObase 0.0036292300147130947 COSMOconf 0.004217753800882786 COSMOmic 9.808729769494851E-5 COSMOperm 0.0012751348700343306 COSMOplex 2.9426189308484553E-4 COSMOquick 0.0014713094654242277 COSMOtherm 0.06503187837175085 Cantera 0.0 Catalyst 0.11819519372241295 Classical Simulations 1.0 Conformers 6.866110838646396E-4 Crystallization 0.07317312408043158 DFTB Plus 0.006081412457086807 DMol3 0.17783227072094163 DPD 0.0028445316331535066 Discover 0.0038254046101029917 Forcite 0.5336929867582149 GULP 0.02412947523295733 Kinetix 1.9617459538989702E-4 LUDI 0.0038254046101029917 LibDock 0.07032859244727807 LigandFit 0.005492888670917117 MCSS 7.846983815595881E-4 MODELER 0.19931338891613537 MesoDyn 0.0012751348700343306 Mesocite 0.004021579205492888 Mesoscale 0.007160372731731241 Modules 0.0 Morphology 0.01696910250122609 ONETEP 9.80872976949485E-4 Polymorph 0.0020598332515939185 QMERA 1.9617459538989702E-4 QSAR 0.0012751348700343306 Quantum Mechanics 0.5609612555174105 Reflex 0.05355566454144188 Reflex Plus 8.827856792545365E-4 Semi-empirical 0.008043158410985777 Sorption 0.054732712113781265 Synthia 0.0016674840608141245 TURBOMOLE 4.904364884747426E-4 VAMP 0.0015693967631191762 Visualization 0.8461991172143207 X-Cell 0.0013732221677292791 ZDOCK 0.02873957822461991

Year

2021 0.0721481078137762 2022 0.15436972502041926 2023 0.2797894545784554 2024 0.7262909519920138 2025 1.0 2026 0.3856974317088665 2027 0.0

Keywords

target 1.0 potential 0.27680237489397796 docking 0.22137404580152673 visualization 0.2061916878710772 analysis 0.190754877014419 between 0.1534351145038168 novel 0.10233248515691264 energy 0.08358778625954198 binding 0.07167090754877015 cell 0.06221374045801527 promising 0.05636132315521628 activity 0.053519932145886344 interaction 0.03507209499575912 stability 0.03375742154368109 synthesized 0.031128074639525022 experimental 0.029558948261238338 performance 0.025148430873621713 development 0.019211195928753182 protein 0.018999151823579304 effective 0.018193384223918575 mechanism 0.017726887192536046 including 0.015267175572519083 synthesis 0.012086513994910942 design 0.0020780322307039864 chemical 0.0
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