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Application

Discovery Studio 1.0 Materials Studio 0.921978021978022 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.04790419161676647 Amorphous Cell 0.27278775781769793 Blends 6.653359946773121E-4 CASTEP 0.25681969394544246 CDOCKER 0.16766467065868262 CHARMm 0.26679973386560213 COMPASS 0.3393213572854291 COMPASS III 0.1157684630738523 COSMObase 0.004657351962741184 COSMOconf 0.00998003992015968 COSMOmic 0.0 COSMOperm 0.0 COSMOplex 6.653359946773121E-4 COSMOtherm 0.07119095143047238 Catalyst 0.07984031936127745 Classical Simulations 1.0 Conformers 0.0 Crystallization 0.07451763140385895 DFTB Plus 0.003992015968063872 DMol3 0.12109115103127079 DPD 0.0013306719893546241 Discover 0.0026613439787092482 Forcite 0.5169660678642715 GULP 0.012641383898868928 Kinetix 0.0 LUDI 0.0026613439787092482 LibDock 0.06986027944111776 LigandFit 0.001996007984031936 MODELER 0.2661343978709248 Mesocite 0.003992015968063872 Mesoscale 0.0053226879574184965 Morphology 0.017964071856287425 ONETEP 0.0013306719893546241 Polymorph 0.0013306719893546241 Quantum Mechanics 0.37391882900864937 Reflex 0.05256154357950765 Semi-empirical 0.004657351962741184 Sorption 0.06187624750499002 Synthia 0.0013306719893546241 TURBOMOLE 0.0 VAMP 0.0 Visualization 0.6932801064537591 X-Cell 0.0 ZDOCK 0.02594810379241517

Year

2024 0.015889830508474576 2025 0.9947033898305084 2026 1.0 2027 0.0

Keywords

target 1.0 potential 0.33252929014472776 docking 0.23845623707787733 analysis 0.23397656788421778 visualization 0.1702274293590627 between 0.1233631977946244 promising 0.09855272226051 novel 0.09407305306685045 binding 0.08304617505168849 energy 0.06064782908339077 cell 0.057546519641626465 activity 0.04893177119228118 stability 0.042729152308752585 performance 0.034114403859407304 including 0.029634734665747762 strong 0.027911784975878703 effective 0.01826326671261199 strategy 0.016195727084769126 synthesized 0.015506547208821502 therapeutic 0.015506547208821502 development 0.014472777394900068 mechanism 0.009993108201240523 enhanced 0.006202618883528601 protein 0.0017229496898690559 design 0.0
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