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Application

Discovery Studio 0.9922277177753104 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06566241792197759 Amorphous Cell 0.27990215012231234 Blends 0.0021887472640659197 CASTEP 0.3637182953521308 CDOCKER 0.16750354062057424 CHARMm 0.2648384189519763 COMPASS 0.3523883095146131 COMPASS III 0.0881936397579503 COSMObase 0.003604995493755633 COSMOconf 0.004506244367194541 COSMOmic 0.0 COSMOperm 7.72499034376207E-4 COSMOplex 1.2874983906270118E-4 COSMOquick 0.0012874983906270116 COSMOtherm 0.06192867258915926 Cantera 0.0 Catalyst 0.11020986223767221 Classical Simulations 1.0 Conformers 9.012488734389082E-4 Crystallization 0.07415990730011587 DFTB Plus 0.004506244367194541 DMol3 0.1635122956096305 DPD 0.0027037466203167246 Discover 0.0034762456546929316 Forcite 0.531221835972705 GULP 0.021243723445345693 Kinetix 2.5749967812540236E-4 LUDI 0.0051499935625080465 LibDock 0.07016866228917214 LigandFit 0.005407493240633449 MCSS 7.72499034376207E-4 MODELER 0.20625724217844726 MesoDyn 9.012488734389082E-4 Mesocite 0.003862495171881035 Mesoscale 0.006823741470323162 Modules 0.0 Morphology 0.01738122827346466 ONETEP 0.0010299987125016094 Polymorph 0.001544998068752414 QMERA 1.2874983906270118E-4 QSAR 7.72499034376207E-4 Quantum Mechanics 0.5180893523883096 Reflex 0.0543324320844599 Reflex Plus 7.72499034376207E-4 Semi-empirical 0.0063087421140723575 Sorption 0.0552336809578988 Synthia 9.012488734389082E-4 TURBOMOLE 5.149993562508047E-4 VAMP 0.001416248229689713 Visualization 0.7791940260074675 X-Cell 0.001416248229689713 ZDOCK 0.028839963950045063

Year

2022 0.07195530726256984 2023 0.23329608938547486 2024 0.5871508379888268 2025 1.0 2026 0.47430167597765366 2027 0.0

Keywords

target 1.0 potential 0.2873951537744641 docking 0.22186626281453867 analysis 0.2011300093196645 visualization 0.1918685927306617 between 0.15045433364398883 novel 0.09966216216216216 energy 0.08393522833178006 binding 0.07473205964585275 promising 0.06535414725069898 cell 0.06407269338303821 activity 0.05131640260950606 stability 0.04007455731593663 performance 0.03343429636533085 interaction 0.029881174277726002 synthesized 0.02615330848089469 experimental 0.02504659832246039 effective 0.02114398881640261 mechanism 0.02015377446411929 including 0.019920782851817333 development 0.018173345759552657 protein 0.016833643988816403 synthesis 0.0097856477166822 design 0.0033783783783783786 enhanced 0.0
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