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Application

Discovery Studio 1.0 Materials Studio 0.990449661758854 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06643757159221077 Amorphous Cell 0.2779339789649068 Blends 0.002499218994064355 CASTEP 0.38102676247006145 CDOCKER 0.1707799645943976 CHARMm 0.2627303967510153 COMPASS 0.35665937727793395 COMPASS III 0.08414037280016662 COSMObase 0.0035405602415911693 COSMOconf 0.004165364990107258 COSMOmic 2.082682495053629E-4 COSMOperm 0.001353743621784859 COSMOplex 1.0413412475268145E-4 COSMOquick 0.0014578777465375403 COSMOtherm 0.06227220660210351 Cantera 0.0 Catalyst 0.11912943871706758 Classical Simulations 1.0 Conformers 0.0010413412475268145 Crystallization 0.07310215557638237 DFTB Plus 0.00499843798812871 DMol3 0.1717171717171717 DPD 0.002707487243569718 Discover 0.003644694366343851 Forcite 0.5349369988545246 GULP 0.023534312194106007 Kinetix 2.082682495053629E-4 LUDI 0.004894303863376029 LibDock 0.07049880245756535 LigandFit 0.005935645110902843 MCSS 8.330729980214516E-4 MODELER 0.19670936165781527 MesoDyn 0.001145475372279496 Mesocite 0.0033322919920858065 Mesoscale 0.006664583984171613 Modules 0.0 Morphology 0.016869728209934397 ONETEP 0.001145475372279496 Polymorph 0.0017702801207955846 QMERA 2.082682495053629E-4 QSAR 8.330729980214516E-4 Quantum Mechanics 0.5422263875872123 Reflex 0.053837342497136315 Reflex Plus 9.372071227741331E-4 Semi-empirical 0.006664583984171613 Sorption 0.055503488493179216 Synthia 0.001145475372279496 TURBOMOLE 5.206706237634072E-4 VAMP 0.0012496094970321774 Visualization 0.8242215974174737 X-Cell 0.0012496094970321774 ZDOCK 0.02853275018223472

Year

2021 0.003115264797507788 2022 0.13707165109034267 2023 0.28211471504489644 2024 0.6440351841671248 2025 1.0 2026 0.38949972512369435 2027 0.0

Keywords

target 1.0 potential 0.28381283446919453 docking 0.222933723642684 visualization 0.20399762155239445 analysis 0.1959932305721996 between 0.1540044824589489 novel 0.10437725838174083 energy 0.08658464071719343 binding 0.07588162649224718 cell 0.06417234597264786 promising 0.061382243973837076 activity 0.055253167451859306 stability 0.0374605497873119 interaction 0.03727759227919316 synthesized 0.031697388281571606 performance 0.029959291954443582 experimental 0.02739788684078123 mechanism 0.022640991629694004 effective 0.022458034121575265 development 0.019713671499794173 including 0.01939349586058638 protein 0.018615926451081736 synthesis 0.013538855600786718 design 0.0034304532772263642 chemical 0.0
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