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Application

Discovery Studio 0.9819551854055126 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.0690173206079887 Amorphous Cell 0.26926475786496995 Antibody 1.7674089784376105E-4 Blends 0.003004595263343938 CASTEP 0.41366207140332273 CDOCKER 0.18301519971721456 CHARMm 0.26581831035701664 COMPASS 0.3708024036762107 COMPASS III 0.06663131848709791 COSMObase 0.002827854365500177 COSMOconf 0.003181336161187699 COSMOmic 3.534817956875221E-4 COSMOperm 0.0010604453870625664 COSMOplex 2.651113467656416E-4 COSMOquick 0.0019441498762813715 COSMOtherm 0.06468716861081654 Cantera 0.0 Catalyst 0.12760692824319547 Classical Simulations 1.0 Conformers 0.0015906680805938495 Crystallization 0.07741251325556733 DFTB Plus 0.005390597384234712 DMol3 0.19697773064687168 DPD 0.003534817956875221 Discover 0.006274301873453517 Forcite 0.5227995758218452 GULP 0.027571580063626724 Kinetix 1.7674089784376105E-4 LUDI 0.0069812654648285614 LibDock 0.07034287734181689 LigandFit 0.01175326970661011 MCSS 0.00167903852951573 MODELER 0.22896783315659244 MesoDyn 0.001502297631671969 Mesocite 0.005213856486390951 Mesoscale 0.009190526687875575 Modules 0.0 Morphology 0.0172322375397667 ONETEP 0.00167903852951573 Polymorph 0.001855779427359491 QMERA 2.651113467656416E-4 QSAR 0.00167903852951573 Quantum Mechanics 0.5980028278543655 Reflex 0.05770590314598798 Reflex Plus 0.0010604453870625664 Reflex QPA 0.0 Semi-empirical 0.007776599505125486 Sorption 0.05249204665959703 Synthia 8.837044892188052E-4 TURBOMOLE 7.069635913750442E-4 VAMP 0.0019441498762813715 Visualization 0.7957758925415341 X-Cell 0.001502297631671969 ZDOCK 0.030045952633439378

Year

2017 0.0 2018 0.08411104548139398 2019 0.12982870643827524 2020 0.14754873006497343 2021 0.18322504430005906 2022 0.3567631423508565 2023 0.5918487891317188 2024 0.8154754873006498 2025 1.0 2026 0.49923213230950975 2027 0.0011813349084465446

Keywords

target 1.0 potential 0.23803764456875048 docking 0.19298510847380754 visualization 0.18119283392546678 analysis 0.16331544334416812 between 0.15133419003703982 novel 0.0936956686068486 energy 0.07876634666263511 binding 0.06262756066218157 cell 0.0553707763247411 activity 0.049285660291783204 promising 0.03806032201980497 interaction 0.034507521354599745 experimental 0.026381434726736715 synthesized 0.02354675334492403 mechanism 0.019427016403356263 stability 0.018028573588328673 protein 0.013455287625670874 performance 0.012056844810643284 development 0.008579635648953058 effective 0.00846624839368055 synthesis 0.006841031068107945 design 0.0031748431476302063 chemical 3.401617658175221E-4 including 0.0
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