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Application

Discovery Studio 1.0 Materials Studio 0.5839094908862351 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.0484048404840484 Amorphous Cell 0.23487348734873487 Blends 0.0016501650165016502 CASTEP 0.264026402640264 CDOCKER 0.2717271727172717 CHARMm 0.3976897689768977 COMPASS 0.3063806380638064 COMPASS III 0.06050605060506051 COSMObase 0.0022002200220022 COSMOconf 0.0016501650165016502 COSMOmic 0.0 COSMOperm 0.0027502750275027505 COSMOplex 0.0 COSMOquick 0.0033003300330033004 COSMOtherm 0.0594059405940594 Catalyst 0.20957095709570958 Classical Simulations 1.0 Conformers 0.0 Crystallization 0.0539053905390539 DFTB Plus 0.0049504950495049506 DMol3 0.17766776677667767 DPD 0.0022002200220022 Discover 0.0033003300330033004 Forcite 0.4438943894389439 GULP 0.0121012101210121 LUDI 0.01485148514851485 LibDock 0.10946094609460946 LigandFit 0.01485148514851485 MCSS 0.0038503850385038503 MODELER 0.2761276127612761 MesoDyn 0.0016501650165016502 Mesocite 0.0038503850385038503 Mesoscale 0.007700770077007701 Morphology 0.0165016501650165 ONETEP 0.0011001100110011 Polymorph 0.0011001100110011 QSAR 0.0033003300330033004 Quantum Mechanics 0.4312431243124312 Reflex 0.036303630363036306 Reflex Plus 0.0 Semi-empirical 0.005500550055005501 Sorption 0.0374037403740374 Synthia 0.0011001100110011 TURBOMOLE 0.0 VAMP 0.0 Visualization 0.9240924092409241 X-Cell 0.0 ZDOCK 0.04565456545654566

Year

2021 0.0 2022 0.15902140672782875 2023 0.3195718654434251 2024 0.9747706422018348 2025 1.0 2026 0.11085626911314984

Keywords

development 1.0 target 0.9533022014676451 potential 0.3386702245941739 docking 0.25394707582833 novel 0.20569268401156326 visualization 0.18167667333778073 analysis 0.16121859017122525 between 0.104736490993996 binding 0.0913942628418946 promising 0.08805870580386925 activity 0.0733822548365577 effective 0.05514787636201912 protein 0.05003335557038025 design 0.04269513008672448 cell 0.037135868356682235 drug 0.03669112741827885 interaction 0.02334889926617745 including 0.019568601289748723 treatment 0.01712252612853013 stability 0.00822770736046253 energy 0.00689348454525239 therapeutic 0.00622637313764732 compound 0.005114520791638871 mechanism 0.004447409384033801 synthesized 0.0
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