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Application

Discovery Studio 1.0 Materials Studio 0.9621794114170902 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06323506949747976 Amorphous Cell 0.2753933099129372 Blends 0.0019856422789063695 CASTEP 0.3522223919352375 CDOCKER 0.1713762028409959 CHARMm 0.2764625019092714 COMPASS 0.33969757140675116 COMPASS III 0.09439437910493356 COSMObase 0.0042767679853367956 COSMOconf 0.005193218267908966 COSMOmic 0.0 COSMOperm 6.109668550481136E-4 COSMOplex 1.527417137620284E-4 COSMOquick 0.0015274171376202842 COSMOtherm 0.06323506949747976 Cantera 0.0 Catalyst 0.10233694822055904 Classical Simulations 1.0 Conformers 7.637085688101421E-4 Crystallization 0.07102489689934322 DFTB Plus 0.004124026271574767 DMol3 0.15885138231250956 DPD 0.002291125706430426 Discover 0.003665801130288682 Forcite 0.5220711776386131 GULP 0.019856422789063695 Kinetix 1.527417137620284E-4 LUDI 0.0042767679853367956 LibDock 0.07239957232320146 LigandFit 0.004124026271574767 MCSS 6.109668550481136E-4 MODELER 0.23461127233847565 MesoDyn 7.637085688101421E-4 Mesocite 0.003360317702764625 Mesoscale 0.005956926836719108 Modules 0.0 Morphology 0.01634336337253704 ONETEP 0.0010691919963341989 Polymorph 0.0016801588513823125 QMERA 1.527417137620284E-4 QSAR 7.637085688101421E-4 Quantum Mechanics 0.5008400794256912 Reflex 0.05193218267908966 Reflex Plus 7.637085688101421E-4 Semi-empirical 0.005651443409195051 Sorption 0.054223308385520086 Synthia 9.164502825721705E-4 TURBOMOLE 3.054834275240568E-4 VAMP 0.0010691919963341989 Visualization 0.7759279059111043 X-Cell 0.0016801588513823125 ZDOCK 0.028715442187261343

Year

2022 0.0 2023 0.15800788247939807 2024 0.47330705840200643 2025 1.0 2026 0.5069867431028305 2027 0.0011943150603129105

Keywords

target 1.0 potential 0.29913750788864735 docking 0.23076923076923078 analysis 0.20952247387981207 visualization 0.1873641399621345 between 0.14963887525418976 novel 0.0986606829815581 energy 0.07629198513428231 binding 0.07467919500736274 promising 0.07292616226071102 cell 0.058972021597363436 activity 0.05132879882196199 stability 0.040109389243391066 performance 0.030222284552275436 synthesized 0.02222845522754365 including 0.021106514269686558 interaction 0.020896150340088352 experimental 0.018441904494775962 effective 0.016338265198793913 development 0.01563705210013323 mechanism 0.015005960311338615 protein 0.014585232452142206 synthesis 0.0056097047892854635 enhanced 5.609704789285464E-4 design 0.0
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