Publications

Light-Induced Redox Reactions in Nanocrystalline Systems

A review with 156 refs. on interfacial electron transfer reactions in colloidal semiconductor solns. and thin films and their application for solar light energy conversion and p...

AutoDock Vina 1.2.0: New Docking Methods, Expanded Force Field, and Python Bindings

AutoDock Vina is arguably one of the fastest and most widely used open-source programs for molecular docking. However, compared to other programs in the AutoDock Suite, it lacks...

Clinical and Laboratory Standards Institute

Merck molecular force field. I. Basis, form, scope, parameterization, and performance of MMFF94

This article introduces MMFF94, the initial published version of the Merck molecular force field (MMFF). It describes the objectives set for MMFF, the form it takes, and the ran...

A new framework for developing and evaluating complex interventions: update of Medical Research Council guidance

Complex interventions are commonly used in the health and social care services, public health practice, and other areas of social and economic policy that have consequences for ...

Climate Change 2021 – The Physical Science Basis

The Working Group I contribution to the Sixth Assessment Report of the Intergovernmental Panel on Climate Change (IPCC) provides a comprehensive assessment of the physical scien...

Hay fever, hygiene, and household size.

chemical findings stable.The packed cell volume was 0 27.With hypertonic peritoneal dialysis his weight decreased by 1 6 kg, but blood pressure remained raised at 230/130 mm Hg,...

Clinical and immunological features of severe and moderate coronavirus disease 2019

BACKGROUNDSince December 2019, an outbreak of coronavirus disease 2019 (COVID-19) caused by severe acute respiratory syndrome coronavirus 2 (SARS-CoV-2) emerged in Wuhan, and is...

Gaussian-Type Functions for Polyatomic Systems. I

In view of rapid progress of computer capability, it is very desirable to have a reliable assessment of the usefulness of Gaussian-type orbitals as basis functions for large-sca...

The OPLS [optimized potentials for liquid simulations] potential functions for proteins, energy minimizations for crystals of cyclic peptides and crambin

ADVERTISEMENT RETURN TO ISSUEPREVarticleNEXTThe OPLS [optimized potentials for liquid simulations] potential functions for proteins, energy minimizations for crystals of cyclic ...

IPCC special report on carbon dioxide capture and storage

Prepared by the Intergovernmental Panel on Climate Change, this report assesses the current state of knowledge regarding the technical, scientific, environmental, economic, and ...

Classification and Diagnosis of Diabetes Mellitus and Other Categories of Glucose Intolerance

A classification of diabetes and other categories of glucose intolerance, based on contemporary knowledge of this heterogeneous syndrome, was developed by an international workg...