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Application

Discovery Studio 0.8381727725011308 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06801159700410728 Amorphous Cell 0.2882338729161633 Blends 0.002536844648465813 CASTEP 0.3911572843682049 CDOCKER 0.14604977047596038 CHARMm 0.2347185310461464 COMPASS 0.3654264315051945 COMPASS III 0.09289683498429573 COSMObase 0.004107272287992268 COSMOconf 0.004952887170814206 COSMOmic 1.2080212611741966E-4 COSMOperm 0.0013288233872916163 COSMOplex 2.4160425223483932E-4 COSMOquick 0.0015704276395264558 COSMOtherm 0.06523314810340662 Cantera 0.0 Catalyst 0.09205122010147379 Classical Simulations 1.0 Conformers 7.24812756704518E-4 Crystallization 0.07344769267939116 DFTB Plus 0.005798502053636144 DMol3 0.17407586373520173 DPD 0.0026576467745832327 Discover 0.00362406378352259 Forcite 0.5543609567528388 GULP 0.023194008214544575 Kinetix 2.4160425223483932E-4 LUDI 0.002899251026818072 LibDock 0.06209229282435371 LigandFit 0.0037448659096400096 MCSS 4.8320850446967865E-4 MODELER 0.2046388016429089 MesoDyn 7.24812756704518E-4 Mesocite 0.0033824595312877508 Mesoscale 0.006281710558105823 Modules 0.0 Morphology 0.017153901908673594 ONETEP 0.0012080212611741967 Polymorph 0.002174438270113554 QMERA 1.2080212611741966E-4 QSAR 9.664170089393573E-4 Quantum Mechanics 0.5537569461222518 Reflex 0.05327373761778207 Reflex Plus 0.001087219135056777 Semi-empirical 0.0073689296931626 Sorption 0.05943464604977047 Synthia 0.0013288233872916163 TURBOMOLE 6.040106305870984E-4 VAMP 0.0012080212611741967 Visualization 0.702343561246678 X-Cell 0.0015704276395264558 ZDOCK 0.024522831601836194

Year

2023 0.1287083936324168 2024 0.4732272069464544 2025 1.0 2026 0.3844066570188133 2027 0.0

Keywords

target 1.0 potential 0.2849222065063649 analysis 0.19717114568599717 docking 0.19394625176803396 visualization 0.16644978783592645 between 0.1598868458274399 energy 0.09957567185289957 novel 0.09759547383309759 promising 0.07049504950495049 cell 0.06794908062234795 binding 0.05968882602545969 performance 0.04537482319660537 stability 0.04220650636492221 activity 0.04186704384724187 experimental 0.03145685997171146 synthesized 0.024837340876944836 interaction 0.024384724186704385 including 0.02087694483734088 effective 0.02036775106082037 mechanism 0.018783592644978784 development 0.01833097595473833 enhanced 0.008712871287128714 synthesis 0.003224893917963225 design 0.001867043847241867 protein 0.0
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