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Application

Discovery Studio 1.0 Materials Studio 0.9299029126213593 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.05972359328726555 Amorphous Cell 0.27591312931885487 Blends 0.0017275419545903258 CASTEP 0.31663376110562685 CDOCKER 0.17398815399802567 CHARMm 0.283563672260612 COMPASS 0.33168805528134254 COMPASS III 0.10241855873642645 COSMObase 0.004689042448173741 COSMOconf 0.006416584402764067 COSMOmic 0.0 COSMOperm 4.935834155972359E-4 COSMOplex 2.4679170779861795E-4 COSMOquick 0.0012339585389930898 COSMOtherm 0.06268509378084897 Catalyst 0.08045409674234946 Classical Simulations 1.0 Conformers 2.4679170779861795E-4 Crystallization 0.07156959526159921 DFTB Plus 0.0027147087857847976 DMol3 0.1443731490621915 DPD 0.0014807502467917078 Discover 0.004442250740375123 Forcite 0.5150542941757157 GULP 0.01826258637709773 Kinetix 0.0 LUDI 0.004442250740375123 LibDock 0.07379072063178677 LigandFit 0.004195459032576505 MCSS 4.935834155972359E-4 MODELER 0.2680157946692991 MesoDyn 4.935834155972359E-4 Mesocite 0.0027147087857847976 Mesoscale 0.004689042448173741 Morphology 0.016041461006910167 ONETEP 4.935834155972359E-4 Polymorph 0.0019743336623889436 QMERA 2.4679170779861795E-4 QSAR 4.935834155972359E-4 Quantum Mechanics 0.45162882527147086 Reflex 0.052566633761105624 Reflex Plus 4.935834155972359E-4 Semi-empirical 0.004442250740375123 Sorption 0.056021717670286277 Synthia 7.403751233958539E-4 TURBOMOLE 0.0 VAMP 9.871668311944718E-4 Visualization 0.7218657453109576 X-Cell 0.0017275419545903258 ZDOCK 0.031095755182625865

Year

2024 0.3702366626554352 2025 1.0 2026 0.7773766546329723 2027 0.0

Keywords

target 1.0 potential 0.31810490693739424 docking 0.2332608170171622 analysis 0.2239545564418661 visualization 0.17089678510998307 between 0.14273628233019095 novel 0.09560067681895093 promising 0.08701957940536621 binding 0.08000966884215616 energy 0.06731931351220691 cell 0.05897993715252599 activity 0.048585931834662796 stability 0.03807106598984772 performance 0.02755620014503263 including 0.023446942228668118 strong 0.013173797437756828 effective 0.012690355329949238 development 0.012327773749093546 synthesized 0.010273144790911288 mechanism 0.0096688421561518 enhanced 0.006043026347594876 experimental 0.004592700024172105 protein 0.004592700024172105 interaction 0.00435097897026831 design 0.0
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