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Application

Discovery Studio 0.980627439641463 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06220951018948874 Amorphous Cell 0.28316052913836254 Blends 0.0021451555237754737 CASTEP 0.34000715051841257 CDOCKER 0.16732213085448694 CHARMm 0.26296031462281017 COMPASS 0.34358240972470505 COMPASS III 0.10314622810153737 COSMObase 0.00446907400786557 COSMOconf 0.005899177690382553 COSMOmic 0.0 COSMOperm 3.575259206292456E-4 COSMOplex 1.787629603146228E-4 COSMOquick 0.0010725777618877368 COSMOtherm 0.06489095459420809 Catalyst 0.08419735430818734 Classical Simulations 1.0 Conformers 3.575259206292456E-4 Crystallization 0.07025384340364677 DFTB Plus 0.003932785126921702 DMol3 0.15302109402931713 DPD 0.001966392563460851 Discover 0.003575259206292456 Forcite 0.5287808366106542 GULP 0.020021451555237754 Kinetix 1.787629603146228E-4 LUDI 0.003575259206292456 LibDock 0.07096889524490525 LigandFit 0.003932785126921702 MCSS 3.575259206292456E-4 MODELER 0.2522345370039328 MesoDyn 7.150518412584912E-4 Mesocite 0.002860207365033965 Mesoscale 0.005362888809438684 Modules 0.0 Morphology 0.016088666428316054 ONETEP 8.93814801573114E-4 Polymorph 0.001966392563460851 QMERA 1.787629603146228E-4 QSAR 5.362888809438684E-4 Quantum Mechanics 0.4839113335716839 Reflex 0.0509474436896675 Reflex Plus 7.150518412584912E-4 Semi-empirical 0.005541651769753307 Sorption 0.056846621380050054 Synthia 0.0010725777618877368 TURBOMOLE 3.575259206292456E-4 VAMP 0.0010725777618877368 Visualization 0.7086163746871649 X-Cell 0.0016088666428316052 ZDOCK 0.02878083661065427

Year

2023 0.0014232849416453174 2024 0.4998576715058355 2025 1.0 2026 0.6041844577284372 2027 0.0

Keywords

target 1.0 potential 0.299600645764296 docking 0.2148865664032628 analysis 0.21140283796414308 visualization 0.16441498852918685 between 0.14793100518310817 novel 0.09609992352791231 promising 0.08029569207239358 energy 0.07783159146911377 binding 0.06933469283711445 cell 0.062452204945195 activity 0.04775257031183618 performance 0.03866088877559691 stability 0.03840598181663693 including 0.02039255671679837 effective 0.01673889030503866 experimental 0.015464355510238764 synthesized 0.015464355510238764 mechanism 0.014444727674398845 development 0.014104851729118871 interaction 0.011810689098479056 enhanced 0.008921743563599286 strong 0.0030588835075197555 protein 0.0027190075622397824 design 0.0
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